data_2mgu_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 2mgu _Structure_validation_residue.Date_analyzed 2016-10-08 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 35.4 tp60 . . . . . 0 C--O 1.232 0.133 0 CA-C-O 120.788 0.328 . . . . 74.299999999999997 110.898 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 69.3 mt -71.72 -37.44 62.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.209 -0.45 . . . . 75.129999999999995 111.133 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -52.18 -32.92 38.4 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.158 -0.474 . . . . 61.149999999999999 111.087 179.796 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 -74.82 -52.1 12.28 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.231 -0.441 . . . . 73.510000000000005 110.893 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 50.1 m-85 -58.34 -46.0 87.07 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.181 -0.463 . . . . 73.209999999999994 110.843 -179.901 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.0 ttpt -54.89 -29.57 56.11 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.124 -0.489 . . . . 74.5 110.929 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -71.18 -30.76 66.82 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.198 -0.456 . . . . 71.019999999999996 110.932 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -64.96 -42.61 94.45 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.157 -0.474 . . . . 72.109999999999999 111.107 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 48.5 t80 -55.41 -54.21 46.62 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.168 -0.469 . . . . 71.549999999999997 110.898 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 36.5 t -51.99 -36.64 50.4 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.112 -0.495 . . . . 71.319999999999993 110.871 -179.812 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 17.7 tp -59.73 -41.62 91.32 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.15 -0.477 . . . . 71.409999999999997 110.897 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 33.9 m-85 -82.59 -25.87 32.85 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.227 -0.442 . . . . 74.310000000000002 110.852 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 11.1 t0 -86.69 98.53 11.18 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.179 -0.464 . . . . 65.530000000000001 110.89 179.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 70.4 mmtt -72.57 -56.85 4.71 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.166 -0.47 . . . . 73.549999999999997 110.894 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 27.1 p-10 -72.84 -10.09 59.4 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.206 -0.452 . . . . 71.299999999999997 110.835 179.922 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 52.05 49.08 50.74 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.759 -0.734 . . . . 73.5 112.465 -179.935 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 31.1 p-10 -88.53 -15.62 34.76 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.855 0.359 . . . . 71.340000000000003 110.871 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 105.31 -11.68 47.69 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.748 -0.739 . . . . 73.400000000000006 112.521 -179.912 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 49.0 p -135.21 130.69 35.66 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.75 0.31 . . . . 73.200000000000003 111.146 -179.879 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 24.7 mt -88.14 126.44 41.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.206 -0.452 . . . . 75.150000000000006 111.109 179.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 60.4 p -110.33 176.2 5.14 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.187 -0.46 . . . . 65.230000000000004 111.143 179.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 21.7 p -64.12 -32.88 74.61 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.242 -0.435 . . . . 71.310000000000002 111.128 -179.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 43.5 mtpt -69.72 -43.53 72.16 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.204 -0.453 . . . . 72.019999999999996 110.932 179.901 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -75.21 -33.74 61.42 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.224 -0.444 . . . . 75.120000000000005 110.903 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.1 tt -74.28 -54.9 6.73 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.132 -0.485 . . . . 74.409999999999997 110.918 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -52.17 -28.53 26.56 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.739 -0.743 . . . . 73.400000000000006 112.467 179.91 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 94.9 m -70.84 -54.83 10.12 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.865 0.364 . . . . 72.439999999999998 111.17 -179.864 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 97.6 t -56.39 -46.67 82.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.171 -0.468 . . . . 75.329999999999998 111.122 179.9 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 31.3 mtp -55.96 -31.57 63.09 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.171 -0.468 . . . . 74.200000000000003 110.838 179.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 12.6 tpt180 -59.83 -53.32 59.28 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.265 -0.425 . . . . 75.310000000000002 110.863 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 2.2 t -61.87 -26.6 68.24 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.185 -0.462 . . . . 71.319999999999993 110.869 -179.775 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 53.8 mt -77.96 -24.62 48.08 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.126 -0.488 . . . . 72.120000000000005 110.948 179.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 100.84 33.08 5.13 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.755 -0.736 . . . . 70.420000000000002 112.451 179.88 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 5.0 tp-100 -130.86 105.82 8.02 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.805 0.336 . . . . 74.540000000000006 110.877 -179.902 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 59.1 t30 -109.92 76.75 1.0 Allowed Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.643 0.735 . . . . 75.329999999999998 110.923 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.75 167.97 22.9 Favored 'Trans proline' 0 C--O 1.232 0.186 0 C-N-CA 122.685 2.256 . . . . 74.450000000000003 112.359 179.933 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 69.7 p -81.62 159.95 23.9 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.199 -0.455 . . . . 63.240000000000002 111.179 -179.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -52.06 -40.45 61.17 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.253 -0.431 . . . . 71.140000000000001 110.858 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.17 -31.48 64.25 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.194 -0.457 . . . . 75.319999999999993 111.081 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 27.1 tt0 -69.73 -45.94 67.01 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.223 -0.444 . . . . 75.329999999999998 110.891 -179.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 29.2 mt -55.33 -51.61 66.18 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.152 -0.476 . . . . 62.43 110.919 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 14.7 tp60 -59.7 -28.98 67.78 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.183 -0.462 . . . . 73.329999999999998 110.885 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -70.28 -49.57 48.41 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.224 -0.443 . . . . 75.299999999999997 110.871 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 7.5 mtp -55.46 -52.65 62.92 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.204 -0.453 . . . . 75.310000000000002 110.863 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 62.8 mt -64.4 -37.72 80.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.257 -0.429 . . . . 74.0 111.128 179.941 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 19.4 m-20 -57.28 -41.74 80.35 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.195 -0.457 . . . . 73.319999999999993 110.912 179.907 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 16.3 mm-40 -53.13 -52.75 57.69 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.167 -0.469 . . . . 74.109999999999999 110.92 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 16.5 m -76.02 -19.26 15.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.155 -0.475 . . . . 75.049999999999997 111.126 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 38.8 t0 -66.86 95.98 0.39 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.165 -0.47 . . . . 51.439999999999998 110.856 179.931 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.21 -42.0 12.59 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.125 -0.488 . . . . 74.340000000000003 111.091 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -82.2 -0.15 43.76 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.245 -0.434 . . . . 75.510000000000005 110.864 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 53.62 60.86 7.67 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.763 -0.732 . . . . 72.329999999999998 112.489 -179.933 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 52.3 p-10 -114.49 -15.81 12.0 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.876 0.37 . . . . 73.150000000000006 110.889 -179.893 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 89.59 19.65 47.69 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.773 -0.727 . . . . 63.420000000000002 112.513 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 33.4 p -152.07 156.78 40.59 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.763 0.316 . . . . 62.439999999999998 111.148 -179.829 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 18.4 mt -93.37 111.04 24.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.209 -0.451 . . . . 74.430000000000007 111.123 179.921 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -75.72 -172.91 2.03 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.154 -0.475 . . . . 73.230000000000004 110.842 179.862 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.52 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 2.4 t80 -65.43 -58.28 12.42 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.633 0.73 . . . . 75.329999999999998 110.849 -179.855 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . 0.52 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 54.0 Cg_endo -69.7 -26.84 27.46 Favored 'Trans proline' 0 C--N 1.342 0.201 0 C-N-CA 122.64 2.227 . . . . 62.439999999999998 112.385 179.987 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 22.9 mt-10 -62.59 -39.99 95.49 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.21 -0.45 . . . . 72.439999999999998 110.872 -179.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 13.2 t80 -74.71 -35.71 62.7 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.14 -0.482 . . . . 73.010000000000005 110.882 -179.896 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 39.8 tp -70.56 -54.2 13.03 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.16 -0.473 . . . . 72.430000000000007 110.896 180.0 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 14.2 t -51.63 -30.4 21.31 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.165 -0.47 . . . . 71.540000000000006 111.176 179.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 37.3 ttp -59.71 -49.94 75.79 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.194 -0.457 . . . . 74.099999999999994 110.899 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 3.1 mmt -70.83 -25.81 63.01 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.184 -0.462 . . . . 75.040000000000006 110.872 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.278 0 CA-C-N 116.212 -0.449 . . . . 73.209999999999994 111.132 179.902 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 65.3 mt . . . . . 0 C--O 1.232 0.147 0 CA-C-O 120.828 0.346 . . . . 72.0 111.142 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . 0.449 ' NE ' ' HZ2' ' M' ' 30' ' ' LYS . 34.2 ttt-85 -71.24 -45.41 63.33 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.195 -0.457 . . . . 72.510000000000005 110.841 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -60.65 -53.77 53.38 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.222 -0.445 . . . . 74.420000000000002 110.893 -179.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -53.45 -47.85 69.34 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.183 -0.462 . . . . 61.039999999999999 111.088 179.896 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 3.0 t80 -52.09 -46.87 65.41 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.22 -0.446 . . . . 73.109999999999999 110.865 -179.899 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 22.5 ttm-85 -69.07 -31.71 70.66 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.154 -0.475 . . . . 75.329999999999998 110.863 -179.919 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 92.5 t -68.92 -27.34 35.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.163 -0.471 . . . . 74.519999999999996 111.121 -179.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 17.9 m-85 -96.35 -26.59 15.31 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.183 -0.462 . . . . 73.129999999999995 110.899 179.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 29.6 t0 -69.48 94.57 0.76 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.141 -0.481 . . . . 71.530000000000001 110.913 179.922 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 9.7 ttmm -78.47 -52.82 7.97 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.223 -0.444 . . . . 74.25 110.895 -179.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 50.3 p30 -72.52 -9.14 58.2 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.176 -0.466 . . . . 71.129999999999995 110.789 179.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 60.17 27.64 65.43 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.77 -0.729 . . . . 75.219999999999999 112.464 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 39.6 p-10 -82.85 -16.22 48.5 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.879 0.371 . . . . 72.329999999999998 110.901 -179.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 86.47 18.67 58.35 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.748 -0.739 . . . . 70.349999999999994 112.473 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 12.4 m-85 -140.47 145.37 36.85 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.852 0.358 . . . . 73.209999999999994 110.929 -179.819 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 66.7 mt -111.5 127.02 68.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.119 -0.492 . . . . 75.310000000000002 111.13 179.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 26.4 p -117.0 174.67 5.97 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.155 -0.475 . . . . 74.409999999999997 110.853 -179.893 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -60.03 -30.02 68.9 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.15 -0.477 . . . . 72.140000000000001 111.113 179.912 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -69.93 -46.12 66.03 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.215 -0.448 . . . . 73.219999999999999 111.089 179.931 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 55.5 mt-10 -72.5 -46.61 53.89 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.218 -0.446 . . . . 75.120000000000005 110.881 -179.893 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 44.1 tp -55.84 -46.54 78.15 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.187 -0.461 . . . . 75.109999999999999 110.951 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 56.8 ttp85 -58.31 -33.76 69.84 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.168 -0.469 . . . . 72.019999999999996 110.9 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 79.6 t60 -72.18 -36.4 69.25 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.176 -0.465 . . . . 74.450000000000003 110.836 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 83.8 t -66.78 -40.82 86.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.2 -0.454 . . . . 74.200000000000003 111.124 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 11.2 mmt -64.15 -27.9 69.39 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.183 -0.462 . . . . 74.209999999999994 110.883 179.91 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 1.5 m -66.08 -42.0 89.95 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.244 -0.435 . . . . 75.099999999999994 111.145 -179.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 33.4 t30 -58.63 -34.3 71.02 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.283 -0.417 . . . . 74.549999999999997 110.922 179.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 18.0 mt -73.25 -26.22 61.02 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.158 -0.474 . . . . 74.530000000000001 110.918 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 100.48 31.1 5.94 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.723 -0.751 . . . . 64.540000000000006 112.508 179.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -108.73 114.68 28.67 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.903 0.382 . . . . 74.310000000000002 110.88 -179.855 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.4 102.03 2.09 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.116 -0.493 . . . . 74.450000000000003 110.899 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 11.1 mt -133.21 146.81 51.82 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.215 -0.448 . . . . 75.329999999999998 110.894 179.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 29.2 p -108.51 -175.39 2.76 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.141 -0.481 . . . . 63.039999999999999 111.115 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 72.6 m-20 -65.57 -38.91 90.92 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.169 -0.468 . . . . 73.239999999999995 110.878 179.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -65.43 -33.47 76.03 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.176 -0.465 . . . . 73.109999999999999 110.93 -179.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 19.0 tt0 -72.11 -49.8 33.28 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.12 -0.491 . . . . 72.530000000000001 110.905 -179.909 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 58.3 t -54.45 -31.16 22.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.175 -0.466 . . . . 75.239999999999995 111.131 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -51.94 -42.7 63.04 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.193 -0.458 . . . . 52.219999999999999 110.879 179.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 11.4 tp10 -62.94 -31.4 72.48 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.164 -0.471 . . . . 74.430000000000007 110.905 -179.909 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 94.8 mtp -72.99 -59.47 2.69 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.098 -0.501 . . . . 74.310000000000002 110.869 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 35.9 mm -53.99 -35.59 28.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.208 -0.451 . . . . 75.310000000000002 111.146 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 39.1 ttt85 -63.33 -31.9 73.18 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.199 -0.455 . . . . 73.140000000000001 110.898 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 19.3 tp10 -74.85 -52.37 11.52 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.137 -0.483 . . . . 75.420000000000002 110.871 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -65.11 -34.43 78.38 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.185 -0.461 . . . . 63.43 111.102 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 49.4 t0 -68.4 86.77 0.29 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.167 -0.47 . . . . 75.099999999999994 110.862 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 58.0 mt -79.83 -46.23 22.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.184 -0.462 . . . . 74.109999999999999 111.085 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 21.2 p30 -72.76 -8.67 56.58 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.176 -0.465 . . . . 62.450000000000003 110.84 179.89 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 62.71 42.99 99.61 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.745 -0.741 . . . . 55.43 112.5 -179.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 34.8 p-10 -88.08 -15.95 34.86 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.881 0.372 . . . . 75.140000000000001 110.89 -179.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 104.1 2.36 45.16 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.733 -0.746 . . . . 60.049999999999997 112.496 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 5.6 tt0 -149.19 172.24 15.15 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.858 0.361 . . . . 74.329999999999998 110.906 -179.85 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 136' ' ' VAL . . . . . . . . . . . . . 94.6 t -107.51 111.31 35.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.233 -0.44 . . . . 75.030000000000001 111.125 179.935 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 44.0 p-10 -92.5 166.13 12.68 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.136 -0.484 . . . . 73.430000000000007 110.934 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 78.1 t80 -51.96 -46.72 64.89 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.203 -0.453 . . . . 75.129999999999995 110.961 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -51.98 -41.04 61.84 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.092 -0.504 . . . . 75.349999999999994 110.913 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -78.44 -36.26 45.7 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.14 -0.482 . . . . 75.140000000000001 110.873 -179.92 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 66.0 t80 -64.67 -35.51 81.27 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.136 -0.484 . . . . 74.109999999999999 110.87 -179.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 94.4 t -69.77 -38.5 76.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.169 -0.468 . . . . 64.140000000000001 111.094 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 45.0 tt0 -71.37 -36.56 71.49 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.19 -0.459 . . . . 73.200000000000003 110.926 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 5.7 tpt -72.81 -29.16 63.03 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.194 -0.457 . . . . 74.340000000000003 110.881 179.969 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -84.32 -27.91 27.45 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.24 -0.436 . . . . 74.049999999999997 110.846 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 87.6 m . . . . . 0 C--N 1.329 -0.284 0 CA-C-N 116.231 -0.44 . . . . 73.530000000000001 111.108 -179.898 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' M' M ' 15' ' ' LYS . . . . . . . . . . . . . 20.0 mttm . . . . . 0 C--O 1.231 0.126 0 CA-C-O 120.735 0.302 . . . . 74.430000000000007 110.871 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' M' M ' 16' ' ' TRP . . . . . . . . . . . . . 7.2 m95 -52.1 -45.9 65.05 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.257 -0.429 . . . . 75.450000000000003 110.931 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' M' M ' 17' ' ' GLU . . . . . . . . . . . . . 15.8 tm-20 -57.52 -27.2 62.38 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.211 -0.449 . . . . 71.25 110.897 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' M' M ' 18' ' ' LYS . . . . . . . . . . . . . 8.9 ttmm -69.93 -27.6 64.9 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.158 -0.473 . . . . 74.510000000000005 110.859 179.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' M' M ' 19' ' ' ILE . . . . . . . . . . . . . 34.3 mt -83.09 -25.22 8.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.245 -0.434 . . . . 75.340000000000003 111.146 179.863 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' M' M ' 20' ' ' ARG . . . . . . . . . . . . . 22.7 ttp180 . . . . . 0 C--N 1.329 -0.311 0 CA-C-N 116.171 -0.468 . . . . 75.329999999999998 110.853 179.967 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' M' M ' 30' ' ' LYS . . . . . 0.449 ' HZ2' ' NE ' ' A' ' 86' ' ' ARG . 17.8 tptt . . . . . 0 C--O 1.232 0.147 0 CA-C-O 120.871 0.367 . . . . 75.040000000000006 110.946 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' M' M ' 31' ' ' LEU . . . . . . . . . . . . . 18.9 tp -179.76 -39.07 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.212 -0.449 . . . . 73.310000000000002 110.896 179.912 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' M' M ' 32' ' ' LYS . . . . . . . . . . . . . 1.6 tmtt? -50.26 -40.95 49.52 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.23 -0.441 . . . . 74.409999999999997 110.907 179.849 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' M' M ' 33' ' ' HIS . . . . . . . . . . . . . 83.9 t60 -50.25 -38.68 41.99 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.23 -0.441 . . . . 73.340000000000003 110.894 179.842 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' M' M ' 34' ' ' ILE . . . . . . . . . . . . . 48.8 mm -50.13 -39.77 16.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.2 -0.455 . . . . 73.519999999999996 111.102 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' M' M ' 35' ' ' VAL . . . . . . . . . . . . . 97.0 t -49.16 -40.18 13.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.228 -0.442 . . . . 74.120000000000005 111.1 179.869 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' M' M ' 36' ' ' TRP . . . . . . . . . . . . . 24.7 m0 -58.57 -39.67 80.98 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.196 -0.456 . . . . 73.299999999999997 110.906 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' M' M ' 37' ' ' ALA . . . . . . . . . . . . . . . -63.99 -18.69 64.54 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.25 -0.432 . . . . 72.319999999999993 111.095 179.864 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' M' M ' 38' ' ' SER . . . . . . . . . . . . . 1.6 m -71.94 -17.93 62.05 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.278 -0.419 . . . . 64.049999999999997 110.876 -179.808 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' M' M ' 39' ' ' ARG . . . . . . . . . . . . . 3.5 tpt180 -57.56 -25.43 59.96 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.122 -0.49 . . . . 62.420000000000002 110.885 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' M' M ' 40' ' ' GLU . . . . . . . . . . . . . 12.4 mt-10 -85.94 -48.12 9.0 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.182 -0.463 . . . . 75.329999999999998 110.897 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' M' M ' 41' ' ' LEU . . . . . . . . . . . . . 9.8 mt . . . . . 0 C--N 1.328 -0.33 0 CA-C-N 116.153 -0.476 . . . . 73.219999999999999 110.919 -179.941 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 16.5 tp60 . . . . . 0 C--O 1.232 0.149 0 CA-C-O 120.761 0.315 . . . . 74.340000000000003 110.873 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 72.0 mt -65.45 -47.25 87.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.201 -0.454 . . . . 75.510000000000005 111.112 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -56.23 -26.48 51.47 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.162 -0.472 . . . . 62.119999999999997 111.097 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -71.43 -44.31 65.11 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.227 -0.442 . . . . 75.120000000000005 110.882 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 26.1 m-85 -75.78 -45.9 33.69 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.207 -0.451 . . . . 75.019999999999996 110.876 -179.941 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 25.6 ttmt -55.47 -26.09 40.46 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.176 -0.466 . . . . 74.140000000000001 110.871 179.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 16.4 mm-40 -71.91 -40.25 68.97 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.24 -0.436 . . . . 71.340000000000003 110.889 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -60.1 -39.21 85.36 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.14 -0.482 . . . . 72.140000000000001 111.123 179.907 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 54.7 t80 -53.04 -52.02 59.86 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.193 -0.458 . . . . 75.439999999999998 110.909 -179.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 6.1 t -54.59 -30.37 54.32 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.171 -0.468 . . . . 74.150000000000006 110.852 -179.797 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 15.5 tp -66.36 -45.04 81.49 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.089 -0.505 . . . . 74.219999999999999 110.929 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 57.3 m-85 -75.2 -26.21 58.81 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.235 -0.439 . . . . 72.200000000000003 110.896 179.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 12.9 t0 -78.27 98.56 5.95 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.108 -0.496 . . . . 61.340000000000003 110.884 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 1.3 tppp? -68.23 -51.97 39.33 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.178 -0.465 . . . . 70.140000000000001 110.894 -179.989 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 23.5 p-10 -79.51 -10.07 59.73 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.225 -0.443 . . . . 63.43 110.815 179.933 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 52.11 42.35 54.83 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.771 -0.728 . . . . 60.009999999999998 112.468 -179.938 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 19.6 p-10 -88.73 -15.69 34.12 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.896 0.379 . . . . 54.409999999999997 110.871 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 104.64 16.72 16.74 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.758 -0.734 . . . . 52.43 112.524 -179.955 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -154.64 130.71 10.25 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.76 0.314 . . . . 75.530000000000001 111.13 -179.834 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 29.3 mt -89.18 123.77 41.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.252 -0.431 . . . . 74.120000000000005 111.108 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 43.5 p -98.58 -177.36 3.65 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.148 -0.478 . . . . 75.239999999999995 111.151 179.954 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 49.4 p -71.5 -39.56 70.75 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.235 -0.439 . . . . 74.140000000000001 111.171 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 45.2 mmtt -68.9 -50.09 52.57 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.192 -0.458 . . . . 75.450000000000003 110.881 179.906 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -59.19 -38.91 80.99 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.219 -0.446 . . . . 73.239999999999995 110.896 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.2 tt -74.3 -56.2 5.15 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.16 -0.473 . . . . 75.010000000000005 110.921 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -52.26 -44.42 57.83 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.748 -0.739 . . . . 74.140000000000001 112.46 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 92.4 m -56.49 -47.25 79.65 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.831 0.348 . . . . 65.400000000000006 111.165 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 97.0 t -62.78 -51.11 76.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.197 -0.456 . . . . 73.040000000000006 111.13 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 21.4 mtp -51.91 -33.87 38.93 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.185 -0.461 . . . . 70.340000000000003 110.891 179.87 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 59.0 ttt85 -57.07 -54.59 45.01 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.271 -0.422 . . . . 74.230000000000004 110.906 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.7 t -60.98 -26.22 67.41 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.196 -0.456 . . . . 53.520000000000003 110.879 -179.836 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 69.7 mt -79.73 -18.91 50.04 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.137 -0.483 . . . . 74.230000000000004 110.904 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 101.55 28.85 6.51 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.753 -0.737 . . . . 71.400000000000006 112.519 179.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 2.9 tt0 -128.69 106.5 8.98 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.776 0.322 . . . . 72.409999999999997 110.901 -179.84 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 6.0 t-20 -109.86 76.9 1.0 Allowed Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.625 0.726 . . . . 71.239999999999995 110.868 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.72 158.99 55.11 Favored 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.711 2.274 . . . . 71.209999999999994 112.361 179.903 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 66.4 p -76.61 160.19 29.63 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.217 -0.447 . . . . 74.319999999999993 111.159 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 7.9 mt-10 -51.97 -39.52 59.45 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.172 -0.467 . . . . 73.319999999999993 110.933 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.26 -31.57 64.17 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.126 -0.488 . . . . 72.540000000000006 111.111 179.895 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 59.8 tt0 -69.71 -47.94 61.33 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.187 -0.461 . . . . 72.549999999999997 110.919 -179.941 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 29.3 mt -55.34 -51.84 65.47 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.126 -0.488 . . . . 74.340000000000003 110.892 -179.961 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 41.4 tp60 -60.05 -28.99 68.23 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.255 -0.43 . . . . 62.219999999999999 110.955 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 39.3 t0 -67.13 -46.61 73.59 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.161 -0.472 . . . . 63.420000000000002 110.853 179.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 10.9 mtp -58.72 -58.03 10.37 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.215 -0.448 . . . . 74.540000000000006 110.872 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 74.1 mt -56.53 -37.56 52.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.224 -0.444 . . . . 74.420000000000002 111.148 179.976 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 63.9 m-20 -69.74 -34.63 74.11 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.17 -0.468 . . . . 75.010000000000005 110.883 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 25.5 mt-10 -61.57 -30.92 70.97 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.168 -0.469 . . . . 71.25 110.912 179.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 6.5 m -109.17 17.99 6.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.144 -0.48 . . . . 70.510000000000005 111.121 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 32.3 t0 -90.11 97.25 11.08 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.176 -0.466 . . . . 72.450000000000003 110.865 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.13 -45.32 10.23 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.151 -0.477 . . . . 72.409999999999997 111.09 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 19.8 p-10 -81.85 -0.09 41.94 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.256 -0.429 . . . . 74.209999999999994 110.86 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 54.35 57.31 17.65 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.736 -0.745 . . . . 74.140000000000001 112.484 -179.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 48.3 p-10 -114.48 -15.71 12.01 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.877 0.37 . . . . 61.450000000000003 110.902 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 90.28 21.94 36.57 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.773 -0.727 . . . . 64.219999999999999 112.489 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 76.0 p -150.94 165.07 34.82 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.731 0.301 . . . . 73.329999999999998 111.119 -179.86 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 28.0 mt -94.61 114.44 31.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.187 -0.461 . . . . 73.430000000000007 111.099 179.891 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -78.41 -172.91 3.07 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.168 -0.469 . . . . 72.310000000000002 110.871 179.838 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.52 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 2.5 t80 -63.97 -58.4 14.75 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-O 121.672 0.748 . . . . 74.340000000000003 110.895 -179.902 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . 0.52 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 53.8 Cg_endo -69.7 -32.08 19.54 Favored 'Trans proline' 0 C--N 1.341 0.136 0 C-N-CA 122.724 2.283 . . . . 74.400000000000006 112.387 179.985 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 74.1 mt-10 -57.25 -42.67 81.94 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.166 -0.47 . . . . 73.230000000000004 110.907 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 78.7 t80 -70.83 -36.45 72.92 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.13 -0.486 . . . . 71.400000000000006 110.9 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 15.4 tp -67.53 -53.7 26.26 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.136 -0.484 . . . . 74.530000000000001 110.973 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 14.9 t -57.24 -29.43 63.78 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.16 -0.473 . . . . 74.150000000000006 111.185 179.899 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 45.8 ttp -61.15 -42.32 98.35 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.176 -0.466 . . . . 73.540000000000006 110.898 179.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 8.8 mtt -79.78 -45.91 17.95 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.217 -0.447 . . . . 73.519999999999996 110.918 179.939 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.317 0 CA-C-N 116.215 -0.448 . . . . 74.109999999999999 111.086 179.886 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 57.8 mt . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.799 0.333 . . . . 73.329999999999998 111.091 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 46.3 ttp180 -71.65 -28.22 63.61 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.181 -0.463 . . . . 74.239999999999995 110.897 179.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 -71.89 -29.14 64.03 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.164 -0.471 . . . . 74.5 110.888 -179.914 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -76.35 -35.64 58.62 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.14 -0.482 . . . . 63.409999999999997 111.096 179.949 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 3.9 t80 -56.82 -49.31 75.79 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.196 -0.456 . . . . 74.030000000000001 110.863 -179.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 10.5 ptm180 -62.82 -26.16 68.6 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.102 -0.499 . . . . 72.519999999999996 110.888 -179.886 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 91.8 t -74.0 -45.74 47.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.201 -0.454 . . . . 75.209999999999994 111.156 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 9.5 m-85 -75.54 -34.76 60.78 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.126 -0.488 . . . . 74.140000000000001 110.864 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 28.5 t0 -64.52 93.05 0.09 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.175 -0.466 . . . . 63.409999999999997 110.867 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 1.5 ttmp? -78.71 -52.75 7.96 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.175 -0.466 . . . . 75.239999999999995 110.883 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 54.1 p-10 -72.71 -9.08 58.21 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.201 -0.454 . . . . 74.420000000000002 110.854 179.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 60.97 33.53 84.21 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.759 -0.734 . . . . 64.540000000000006 112.517 -179.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 40.7 p-10 -85.52 -16.22 40.22 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.876 0.37 . . . . 72.099999999999994 110.896 -179.9 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 85.87 18.63 59.37 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.732 -0.747 . . . . 62.119999999999997 112.497 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 14.5 m-85 -140.75 151.01 44.11 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.833 0.349 . . . . 53.039999999999999 110.947 -179.799 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 64.0 mt -115.82 127.24 73.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.144 -0.48 . . . . 72.109999999999999 111.172 179.877 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 89.4 p -116.62 -171.47 2.02 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.186 -0.461 . . . . 74.340000000000003 110.836 -179.87 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -68.61 -44.77 73.58 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.133 -0.485 . . . . 74.430000000000007 111.085 179.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -63.8 -38.01 89.51 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.223 -0.444 . . . . 63.210000000000001 111.063 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 23.6 mt-10 -76.04 -52.07 10.96 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.216 -0.447 . . . . 74.200000000000003 110.858 -179.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 35.2 tp -53.37 -52.42 59.31 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.192 -0.458 . . . . 75.140000000000001 110.952 179.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 50.8 ttt180 -52.27 -43.48 64.41 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.187 -0.46 . . . . 75.120000000000005 110.883 179.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 77.6 t60 -54.27 -34.43 60.81 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.147 -0.478 . . . . 74.239999999999995 110.893 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 92.8 t -70.25 -48.28 62.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.18 -0.463 . . . . 74.349999999999994 111.133 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -64.4 -28.23 69.54 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.186 -0.461 . . . . 73.200000000000003 110.877 179.885 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 15.6 m -62.53 -30.95 71.66 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.238 -0.437 . . . . 74.319999999999993 111.145 -179.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -74.71 -25.34 59.06 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.258 -0.428 . . . . 74.340000000000003 110.899 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -70.63 -25.68 63.14 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.137 -0.483 . . . . 72.430000000000007 110.948 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 99.62 19.77 19.22 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.747 -0.739 . . . . 61.200000000000003 112.466 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -103.44 112.86 25.96 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.961 0.41 . . . . 74.219999999999999 110.862 -179.845 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 16.2 mtpp -65.07 124.59 22.51 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.167 -0.47 . . . . 74.140000000000001 110.86 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 5.2 mt -138.65 160.51 39.46 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.234 -0.439 . . . . 75.420000000000002 110.883 179.909 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 34.5 p -118.87 167.61 11.55 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.161 -0.472 . . . . 63.439999999999998 111.113 179.976 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 51.8 m-20 -52.34 -35.83 51.9 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.24 -0.437 . . . . 75.200000000000003 110.882 179.915 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 84.4 tt0 -72.81 -35.34 67.31 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.18 -0.464 . . . . 64.400000000000006 110.916 -179.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 36.2 tp10 -64.8 -44.54 89.59 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.138 -0.483 . . . . 63.130000000000003 110.872 -179.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 58.3 t -57.44 -40.46 74.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.159 -0.473 . . . . 70.010000000000005 111.092 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -52.2 -49.82 63.13 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.235 -0.439 . . . . 64.219999999999999 110.83 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 15.7 tp10 -55.8 -29.43 59.71 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.21 -0.45 . . . . 74.530000000000001 110.93 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 2.9 ttt -72.65 -59.87 2.51 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.149 -0.478 . . . . 65.349999999999994 110.876 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 33.7 mm -54.25 -35.72 30.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.229 -0.441 . . . . 75.439999999999998 111.129 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 40.8 ttt180 -63.41 -31.79 73.04 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.172 -0.467 . . . . 75.239999999999995 110.869 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 12.2 tm-20 -72.85 -50.65 22.67 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.169 -0.469 . . . . 74.530000000000001 110.932 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -69.68 -26.83 64.56 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.145 -0.48 . . . . 72.409999999999997 111.091 179.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 51.2 t0 -75.04 86.49 2.34 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.241 -0.436 . . . . 73.049999999999997 110.853 179.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 4.9 mt -79.89 -45.19 22.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.215 -0.448 . . . . 75.129999999999995 111.139 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 18.2 p30 -72.42 -8.9 57.46 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.206 -0.452 . . . . 75.319999999999993 110.853 179.843 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 62.64 43.95 98.24 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.705 -0.759 . . . . 64.540000000000006 112.455 -179.927 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 33.7 p-10 -89.56 -15.96 31.71 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.858 0.361 . . . . 73.150000000000006 110.839 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 101.63 3.86 52.62 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.719 -0.753 . . . . 55.32 112.526 -179.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 4.7 tt0 -149.2 172.23 15.17 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.796 0.332 . . . . 73.120000000000005 110.918 -179.863 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 136' ' ' VAL . . . . . . . . . . . . . 95.9 t -114.08 111.49 36.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.197 -0.456 . . . . 73.530000000000001 111.131 179.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 14.7 p30 -91.46 170.96 9.53 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.215 -0.448 . . . . 74.150000000000006 110.909 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 45.5 t80 -55.01 -47.37 74.76 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.141 -0.481 . . . . 74.040000000000006 110.953 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -52.25 -50.62 61.7 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.112 -0.494 . . . . 72.040000000000006 110.879 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 95.6 mt-10 -66.77 -31.72 72.55 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.152 -0.476 . . . . 75.430000000000007 110.885 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 49.8 t80 -67.61 -50.18 59.4 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.147 -0.479 . . . . 74.200000000000003 110.861 -179.946 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 73.0 t -62.79 -38.5 81.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.172 -0.467 . . . . 75.219999999999999 111.102 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 64.6 tt0 -57.46 -36.71 71.8 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.183 -0.462 . . . . 75.530000000000001 110.941 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 11.5 tpt -74.3 -55.47 5.98 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.182 -0.463 . . . . 75.25 110.896 179.938 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 21.0 ttm -59.42 -22.44 61.45 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.225 -0.443 . . . . 74.120000000000005 110.865 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 94.8 m . . . . . 0 C--N 1.33 -0.259 0 CA-C-N 116.249 -0.432 . . . . 71.150000000000006 111.167 -179.973 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' M' M ' 15' ' ' LYS . . . . . . . . . . . . . 4.3 mtmp? . . . . . 0 C--O 1.231 0.116 0 CA-C-O 120.757 0.313 . . . . 75.439999999999998 110.895 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' M' M ' 16' ' ' TRP . . . . . . . . . . . . . 44.3 m95 -51.83 -30.12 22.14 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.233 -0.439 . . . . 75.239999999999995 110.92 179.891 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' M' M ' 17' ' ' GLU . . . . . . . . . . . . . 5.4 tm-20 -54.25 -39.32 66.72 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.983 0.42 . . . . 75.430000000000007 110.911 -179.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' M' M ' 18' ' ' LYS . . . . . . . . . . . . . 4.8 ttpm? -62.82 -23.44 67.27 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.12 -0.491 . . . . 74.219999999999999 110.887 179.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' M' M ' 19' ' ' ILE . . . . . . . . . . . . . 21.8 mm -70.89 -34.35 55.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.209 -0.45 . . . . 71.519999999999996 111.105 179.924 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' M' M ' 20' ' ' ARG . . . . . . . . . . . . . 25.4 ttm180 . . . . . 0 C--N 1.329 -0.326 0 CA-C-N 116.192 -0.458 . . . . 71.400000000000006 110.868 179.961 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' M' M ' 30' ' ' LYS . . . . . . . . . . . . . 8.1 pttm . . . . . 0 C--O 1.232 0.149 0 CA-C-O 120.815 0.34 . . . . 75.340000000000003 110.888 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' M' M ' 31' ' ' LEU . . . . . . . . . . . . . 19.4 tp -121.92 -34.66 3.32 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.242 -0.435 . . . . 75.120000000000005 110.891 179.938 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' M' M ' 32' ' ' LYS . . . . . . . . . . . . . 4.8 pttm -51.31 -39.85 57.79 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.223 -0.444 . . . . 74.0 110.865 179.838 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' M' M ' 33' ' ' HIS . . . . . . . . . . . . . 10.4 t-160 -50.92 -36.74 40.02 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.245 -0.434 . . . . 74.239999999999995 110.848 179.91 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' M' M ' 34' ' ' ILE . . . . . . . . . . . . . 50.7 mm -50.16 -39.17 15.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.203 -0.453 . . . . 75.099999999999994 111.136 -179.961 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' M' M ' 35' ' ' VAL . . . . . . . . . . . . . 58.3 t -49.31 -39.76 13.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.161 -0.472 . . . . 74.409999999999997 111.144 179.836 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' M' M ' 36' ' ' TRP . . . . . . . . . . . . . 23.0 m0 -58.64 -39.36 80.32 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.141 -0.481 . . . . 73.420000000000002 110.931 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' M' M ' 37' ' ' ALA . . . . . . . . . . . . . . . -63.84 -18.65 64.36 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.23 -0.441 . . . . 74.239999999999995 111.05 179.935 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' M' M ' 38' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -72.9 -18.06 61.45 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.229 -0.441 . . . . 75.439999999999998 110.853 -179.811 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' M' M ' 39' ' ' ARG . . . . . . . . . . . . . 20.0 ptt180 -57.69 -26.3 61.51 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.17 -0.468 . . . . 74.109999999999999 110.873 -179.899 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' M' M ' 40' ' ' GLU . . . . . . . . . . . . . 12.7 tp10 -85.86 -47.94 9.22 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.161 -0.472 . . . . 74.340000000000003 110.856 -179.914 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' M' M ' 41' ' ' LEU . . . . . . . . . . . . . 13.3 mt . . . . . 0 C--N 1.328 -0.338 0 CA-C-N 116.163 -0.471 . . . . 73.030000000000001 110.866 -179.917 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 18.5 tt0 . . . . . 0 C--O 1.232 0.157 0 CA-C-O 120.801 0.334 . . . . 62.539999999999999 110.883 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 60.5 mt -65.56 -37.12 79.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.242 -0.435 . . . . 73.530000000000001 111.167 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -54.6 -51.83 64.1 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.176 -0.465 . . . . 72.319999999999993 111.126 179.784 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -62.34 -49.2 76.52 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.174 -0.466 . . . . 72.5 110.918 -179.959 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 14.2 m-85 -55.85 -45.82 78.34 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.155 -0.475 . . . . 63.530000000000001 110.849 -179.941 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 26.6 ttpt -55.46 -25.95 39.47 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.163 -0.472 . . . . 70.310000000000002 110.927 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 16.2 tt0 -75.11 -31.07 61.05 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.178 -0.465 . . . . 75.430000000000007 110.856 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -70.67 -33.41 70.91 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.14 -0.482 . . . . 63.240000000000002 111.096 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 93.9 t80 -75.56 -54.21 7.37 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.232 -0.44 . . . . 65.310000000000002 110.886 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 17.4 t -53.23 -29.56 33.21 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.134 -0.485 . . . . 52.43 110.888 -179.827 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 16.1 tp -63.58 -41.82 98.33 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.114 -0.494 . . . . 74.519999999999996 110.873 -179.954 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 20.1 m-85 -77.55 -30.9 52.95 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.194 -0.457 . . . . 72.040000000000006 110.9 179.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 13.3 t0 -76.96 98.62 4.99 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.124 -0.489 . . . . 73.420000000000002 110.877 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 6.2 tptt -66.47 -49.93 64.99 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.186 -0.461 . . . . 72.25 110.938 179.948 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 24.7 p-10 -81.87 -10.2 59.38 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.237 -0.438 . . . . 75.030000000000001 110.852 179.878 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 51.59 44.84 54.33 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.773 -0.727 . . . . 73.310000000000002 112.427 -179.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 29.4 p-10 -88.32 -15.52 35.48 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.852 0.358 . . . . 74.230000000000004 110.897 179.989 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 105.45 -11.63 47.1 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.746 -0.74 . . . . 72.439999999999998 112.474 -179.943 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 32.8 p -130.4 130.6 44.55 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.734 0.302 . . . . 72.430000000000007 111.159 -179.831 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 24.2 mt -96.34 112.64 28.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.236 -0.438 . . . . 71.230000000000004 111.143 179.924 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 21.0 p -95.57 175.52 6.52 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.199 -0.455 . . . . 63.439999999999998 111.162 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 60.4 p -60.35 -37.2 79.92 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.23 -0.441 . . . . 63.539999999999999 111.154 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 19.9 mmmt -60.23 -50.11 74.95 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.209 -0.451 . . . . 74.439999999999998 110.932 179.857 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -72.11 -32.73 67.25 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.213 -0.448 . . . . 70.340000000000003 110.876 179.986 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -67.83 -44.48 77.12 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.145 -0.479 . . . . 72.219999999999999 110.951 179.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -71.7 -27.94 70.03 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.721 -0.752 . . . . 75.150000000000006 112.532 179.87 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 96.5 m -70.31 -53.64 15.95 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.867 0.365 . . . . 73.310000000000002 111.128 -179.869 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 46.8 t -52.53 -51.7 32.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.189 -0.459 . . . . 75.319999999999993 111.105 179.937 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -51.89 -39.41 58.99 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.174 -0.466 . . . . 74.219999999999999 110.895 179.919 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 21.7 ttt-85 -57.01 -44.67 83.05 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.241 -0.436 . . . . 73.439999999999998 110.824 -179.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.1 p -67.49 -26.34 66.31 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.217 -0.447 . . . . 75.219999999999999 110.835 -179.74 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 48.7 mt -85.64 -21.39 28.44 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.084 -0.507 . . . . 70.219999999999999 110.927 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 101.44 31.14 5.64 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.736 -0.745 . . . . 73.319999999999993 112.498 179.941 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 10.6 mt-30 -119.56 122.69 42.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.777 0.322 . . . . 63.329999999999998 110.94 -179.896 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 22.7 t-20 -109.86 76.84 0.99 Allowed Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 121.627 0.727 . . . . 75.150000000000006 110.918 -179.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.76 140.23 42.19 Favored 'Trans proline' 0 C--N 1.342 0.196 0 C-N-CA 122.68 2.253 . . . . 73.540000000000006 112.359 179.938 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 29.6 p -72.64 161.63 30.53 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.209 -0.45 . . . . 75.310000000000002 111.154 -179.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 67.9 tt0 -52.04 -42.9 63.47 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.22 -0.446 . . . . 73.420000000000002 110.919 179.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.0 -31.54 64.56 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.184 -0.462 . . . . 72.329999999999998 111.131 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 55.5 tt0 -66.22 -50.48 63.69 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.157 -0.474 . . . . 74.420000000000002 110.872 -179.915 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 40.5 mt -55.17 -47.12 75.62 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.153 -0.476 . . . . 75.140000000000001 110.908 -179.954 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 21.1 tp60 -66.42 -29.03 69.09 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.203 -0.453 . . . . 73.510000000000005 110.847 179.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 37.9 t0 -70.68 -49.57 45.88 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.26 -0.427 . . . . 74.209999999999994 110.877 179.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 31.8 mtp -59.54 -57.98 10.6 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.174 -0.466 . . . . 75.400000000000006 110.874 179.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 61.7 mt -53.29 -43.82 51.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.181 -0.463 . . . . 75.140000000000001 111.108 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 71.7 m-20 -64.0 -38.84 92.54 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.145 -0.48 . . . . 75.549999999999997 110.906 179.952 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -60.62 -32.08 71.24 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.185 -0.462 . . . . 72.519999999999996 110.889 179.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 26.5 m -105.31 14.7 7.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.141 -0.481 . . . . 75.310000000000002 111.118 -180.0 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 31.0 t0 -90.07 100.19 13.06 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.201 -0.454 . . . . 64.519999999999996 110.874 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.23 -45.85 9.73 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.206 -0.452 . . . . 64.230000000000004 111.084 179.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 16.8 p-10 -81.67 -0.19 41.55 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.246 -0.433 . . . . 73.420000000000002 110.87 179.952 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 53.42 56.15 21.15 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.743 -0.742 . . . . 63.420000000000002 112.473 -179.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 52.0 p-10 -114.49 -15.71 12.01 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.858 0.361 . . . . 73.299999999999997 110.907 -179.903 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 91.73 15.59 54.26 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.743 -0.741 . . . . 71.239999999999995 112.525 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 40.0 p -148.01 163.75 35.9 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.776 0.322 . . . . 74.25 111.139 -179.843 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 24.2 mt -99.9 109.5 24.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.2 -0.454 . . . . 75.230000000000004 111.141 179.868 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 4.6 t0 -75.42 -172.97 1.94 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.155 -0.475 . . . . 71.049999999999997 110.831 179.863 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.516 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 2.5 t80 -65.68 -58.42 11.62 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 121.618 0.723 . . . . 74.239999999999995 110.891 -179.886 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . 0.516 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 54.1 Cg_endo -69.74 -25.5 28.65 Favored 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.667 2.245 . . . . 72.230000000000004 112.376 179.961 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 17.4 mt-10 -61.61 -43.57 98.62 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.222 -0.444 . . . . 63.329999999999998 110.871 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 21.7 t80 -71.21 -36.21 71.8 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.172 -0.467 . . . . 72.219999999999999 110.921 -179.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 21.4 tp -62.56 -53.79 49.46 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.133 -0.485 . . . . 74.239999999999995 110.901 179.989 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 9.9 t -60.48 -30.96 70.02 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.146 -0.479 . . . . 62.009999999999998 111.116 179.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 7.9 tmm? -61.45 -46.76 88.74 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.233 -0.439 . . . . 74.409999999999997 110.902 179.914 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -76.07 -48.57 20.32 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.216 -0.447 . . . . 75.099999999999994 110.886 179.948 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.321 0 CA-C-N 116.267 -0.424 . . . . 63.109999999999999 111.107 179.923 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 67.3 mt . . . . . 0 C--O 1.232 0.139 0 CA-C-O 120.775 0.322 . . . . 75.530000000000001 111.115 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.06 -32.03 71.22 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.195 -0.457 . . . . 74.430000000000007 110.843 179.991 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 8.3 tm-20 -75.67 -51.67 12.24 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.177 -0.465 . . . . 75.219999999999999 110.85 -179.881 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -54.73 -50.96 67.11 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.163 -0.472 . . . . 61.219999999999999 111.069 179.957 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 22.2 t80 -53.47 -44.49 69.01 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.207 -0.451 . . . . 75.530000000000001 110.839 -179.862 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 1.6 tmm_? -66.64 -46.04 77.05 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.176 -0.465 . . . . 72.239999999999995 110.889 -179.938 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 91.6 t -54.42 -51.02 53.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.18 -0.463 . . . . 75.519999999999996 111.11 -179.994 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 19.6 m-85 -66.13 -27.1 67.78 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.194 -0.457 . . . . 73.140000000000001 110.866 -179.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 31.4 t0 -69.67 95.21 0.85 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.13 -0.487 . . . . 60.439999999999998 110.855 179.989 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 5.7 mptp? -78.42 -52.59 8.33 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.198 -0.455 . . . . 74.109999999999999 110.865 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 44.2 p30 -72.63 -9.04 58.12 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.235 -0.438 . . . . 64.150000000000006 110.902 179.867 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 59.68 27.05 63.35 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.715 -0.755 . . . . 75.340000000000003 112.509 -179.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 40.0 p-10 -82.06 -16.19 50.98 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.847 0.356 . . . . 74.540000000000006 110.882 -179.928 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 84.79 18.67 61.1 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.683 -0.77 . . . . 55.229999999999997 112.517 179.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 20.6 m-85 -140.66 135.26 31.49 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.856 0.36 . . . . 73.420000000000002 110.936 -179.787 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 66.2 mt -102.27 126.83 56.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.125 -0.489 . . . . 75.5 111.164 179.908 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 28.7 p -111.66 -174.59 2.5 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.198 -0.456 . . . . 72.340000000000003 110.844 -179.891 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -71.2 -34.5 70.91 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.113 -0.494 . . . . 71.140000000000001 111.116 179.915 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -71.98 -44.83 62.88 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.209 -0.45 . . . . 75.420000000000002 111.089 179.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -69.09 -50.13 51.01 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.229 -0.441 . . . . 73.030000000000001 110.914 -179.934 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 42.5 tp -52.94 -33.3 50.22 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.183 -0.462 . . . . 74.540000000000006 110.94 179.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 58.4 ttp85 -73.74 -36.95 65.22 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.202 -0.453 . . . . 75.140000000000001 110.896 179.943 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 2.0 t60 -54.34 -38.11 65.66 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.123 -0.49 . . . . 75.310000000000002 110.892 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 23.3 t -69.86 -48.14 65.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.162 -0.472 . . . . 74.349999999999994 111.137 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 2.4 mmt -59.72 -38.27 81.22 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.196 -0.456 . . . . 73.510000000000005 110.902 179.906 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 8.0 m -52.25 -43.03 64.13 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.218 -0.446 . . . . 65.329999999999998 111.176 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -68.34 -28.91 67.56 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.203 -0.453 . . . . 65.25 110.874 179.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 1.1 tt -70.87 -26.12 63.11 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.207 -0.452 . . . . 74.400000000000006 110.893 179.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 99.81 30.57 6.38 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.712 -0.756 . . . . 61.219999999999999 112.476 179.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -115.87 113.39 23.28 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.892 0.377 . . . . 75.519999999999996 110.884 -179.856 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 14.9 pttp -64.19 116.24 5.79 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.187 -0.46 . . . . 73.549999999999997 110.91 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 14.2 mt -145.25 133.36 21.5 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.231 -0.441 . . . . 75.310000000000002 110.893 179.964 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 27.8 p -107.42 -177.13 3.26 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.167 -0.469 . . . . 73.209999999999994 111.153 179.994 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -58.91 -37.78 77.43 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.264 -0.425 . . . . 75.030000000000001 110.826 179.907 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 61.5 tt0 -73.91 -33.92 64.18 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.181 -0.463 . . . . 73.129999999999995 110.86 -179.895 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 10.4 tt0 -74.06 -37.21 64.32 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.172 -0.467 . . . . 73.0 110.874 -179.901 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 61.0 t -74.29 -31.0 27.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.137 -0.483 . . . . 74.349999999999994 111.106 179.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -52.01 -45.32 64.5 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.172 -0.467 . . . . 71.219999999999999 110.864 179.903 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 21.5 tp10 -56.07 -29.69 60.9 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.186 -0.461 . . . . 52.130000000000003 110.887 -179.893 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 14.6 mtp -75.06 -57.39 3.93 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.161 -0.472 . . . . 74.430000000000007 110.823 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 35.8 mm -53.88 -35.65 28.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.233 -0.439 . . . . 71.409999999999997 111.151 -179.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 22.1 ttp85 -63.38 -31.8 73.05 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.125 -0.489 . . . . 74.519999999999996 110.861 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 20.0 tp10 -75.01 -52.41 11.15 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.21 -0.45 . . . . 72.040000000000006 110.861 -179.922 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -64.96 -34.41 78.37 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.175 -0.466 . . . . 65.230000000000004 111.106 179.952 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 49.2 t0 -68.42 86.67 0.29 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.208 -0.451 . . . . 74.310000000000002 110.888 179.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 58.0 mt -79.8 -46.34 22.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.218 -0.446 . . . . 63.240000000000002 111.139 179.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 21.2 p30 -72.66 -8.74 56.83 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.225 -0.443 . . . . 73.230000000000004 110.87 179.837 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 62.79 42.97 99.59 Favored Glycine 0 N--CA 1.452 -0.245 0 C-N-CA 120.738 -0.744 . . . . 50.420000000000002 112.456 -179.912 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 34.6 p-10 -88.07 -15.89 35.05 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.809 0.338 . . . . 71.439999999999998 110.879 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 104.11 2.25 45.11 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.709 -0.758 . . . . 74.299999999999997 112.514 -179.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 4.0 tt0 -149.14 172.24 15.13 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.852 0.358 . . . . 72.019999999999996 110.903 -179.876 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 136' ' ' VAL . . . . . . . . . . . . . 92.9 t -106.75 109.87 29.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.213 -0.449 . . . . 55.409999999999997 111.093 179.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 20.4 p30 -90.97 164.86 13.84 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.15 -0.477 . . . . 72.409999999999997 110.903 179.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 70.1 t80 -52.05 -46.72 65.19 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.135 -0.484 . . . . 73.25 110.922 -179.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 11.5 tm-20 -51.92 -39.98 60.02 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.148 -0.478 . . . . 70.209999999999994 110.873 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 22.5 mt-10 -78.41 -41.69 32.36 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.153 -0.476 . . . . 75.409999999999997 110.929 -179.923 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 64.6 t80 -59.29 -35.8 74.41 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.128 -0.487 . . . . 75.530000000000001 110.899 -179.957 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 91.4 t -71.28 -37.87 67.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.153 -0.476 . . . . 74.340000000000003 111.137 179.953 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 39.9 tp60 -73.94 -31.23 62.95 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.199 -0.455 . . . . 73.439999999999998 110.922 179.986 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 9.0 tpt -74.11 -56.54 4.79 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.2 -0.454 . . . . 75.040000000000006 110.877 179.948 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 12.3 ttm -61.48 -26.09 67.67 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.286 -0.415 . . . . 71.120000000000005 110.879 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 2.5 m . . . . . 0 C--N 1.329 -0.314 0 CA-C-N 116.229 -0.442 . . . . 75.319999999999993 111.107 -179.87 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' M' M ' 15' ' ' LYS . . . . . . . . . . . . . 18.9 mttp . . . . . 0 C--O 1.232 0.135 0 CA-C-O 120.751 0.31 . . . . 64.049999999999997 110.871 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' M' M ' 16' ' ' TRP . . . . . . . . . . . . . 10.6 m95 -51.76 -46.91 64.26 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.247 -0.433 . . . . 75.510000000000005 110.944 179.904 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' M' M ' 17' ' ' GLU . . . . . . . . . . . . . 3.1 tm-20 -55.36 -27.1 45.09 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.189 -0.46 . . . . 75.340000000000003 110.889 -179.965 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' M' M ' 18' ' ' LYS . . . . . . . . . . . . . 8.7 ttmm -75.61 -28.93 59.05 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.127 -0.488 . . . . 74.209999999999994 110.891 179.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' M' M ' 19' ' ' ILE . . . . . . . . . . . . . 54.5 mt -78.95 -24.86 13.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.207 -0.451 . . . . 75.439999999999998 111.166 179.832 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' M' M ' 20' ' ' ARG . . . . . . . . . . . . . 48.7 ttp180 . . . . . 0 C--N 1.329 -0.287 0 CA-C-N 116.154 -0.475 . . . . 73.420000000000002 110.851 179.996 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' M' M ' 30' ' ' LYS . . . . . . . . . . . . . 2.1 ptmt . . . . . 0 C--O 1.232 0.167 0 CA-C-O 120.759 0.314 . . . . 73.349999999999994 110.864 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' M' M ' 31' ' ' LEU . . . . . . . . . . . . . 10.0 tp -118.87 -31.38 4.8 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.233 -0.439 . . . . 73.519999999999996 110.945 179.937 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' M' M ' 32' ' ' LYS . . . . . . . . . . . . . 5.4 mtpm? -49.89 -44.61 50.08 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.155 -0.475 . . . . 75.409999999999997 110.89 179.821 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' M' M ' 33' ' ' HIS . . . . . . . . . . . . . 3.6 t60 -50.71 -37.31 40.72 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.272 -0.422 . . . . 73.329999999999998 110.839 179.909 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' M' M ' 34' ' ' ILE . . . . . . . . . . . . . 49.3 mm -50.27 -39.65 16.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.197 -0.456 . . . . 65.519999999999996 111.12 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' M' M ' 35' ' ' VAL . . . . . . . . . . . . . 40.1 t -49.31 -39.95 13.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.159 -0.473 . . . . 74.219999999999999 111.123 179.876 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' M' M ' 36' ' ' TRP . . . . . . . . . . . . . 24.8 m0 -58.78 -39.45 81.07 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.173 -0.467 . . . . 75.230000000000004 110.96 179.964 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' M' M ' 37' ' ' ALA . . . . . . . . . . . . . . . -64.1 -18.62 64.57 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.257 -0.429 . . . . 74.299999999999997 111.084 179.851 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' M' M ' 38' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -73.29 -17.92 61.26 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.227 -0.442 . . . . 74.150000000000006 110.877 -179.782 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' M' M ' 39' ' ' ARG . . . . . . . . . . . . . 22.5 mmm180 -62.76 -25.18 68.08 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.149 -0.478 . . . . 73.219999999999999 110.837 -179.94 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' M' M ' 40' ' ' GLU . . . . . . . . . . . . . 7.0 mp0 -77.21 -48.03 18.66 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.211 -0.45 . . . . 73.400000000000006 110.898 -179.917 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' M' M ' 41' ' ' LEU . . . . . . . . . . . . . 18.0 mt . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 116.103 -0.499 . . . . 73.409999999999997 110.904 -179.932 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 19.3 tt0 . . . . . 0 C--O 1.232 0.137 0 CA-C-O 120.794 0.33 . . . . 74.209999999999994 110.864 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 64.2 mt -69.84 -37.23 72.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.186 -0.461 . . . . 74.25 111.139 179.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -52.16 -50.81 61.06 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.203 -0.453 . . . . 75.209999999999994 111.097 179.831 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 17.5 mt-10 -57.02 -52.22 66.14 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.187 -0.46 . . . . 74.010000000000005 110.847 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 45.7 m-85 -58.02 -42.36 85.09 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.206 -0.452 . . . . 75.129999999999995 110.879 -179.907 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 21.7 ttpp -51.88 -41.26 61.77 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.114 -0.494 . . . . 74.140000000000001 110.932 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 56.5 tt0 -62.81 -32.87 74.15 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.261 -0.427 . . . . 74.510000000000005 110.829 180.0 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -68.91 -37.63 79.07 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.15 -0.477 . . . . 74.310000000000002 111.062 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 89.8 t80 -69.96 -53.22 18.77 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.257 -0.429 . . . . 75.310000000000002 110.912 -179.911 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 1.7 t -52.04 -35.79 48.3 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.153 -0.476 . . . . 71.230000000000004 110.855 -179.824 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 18.7 tp -59.81 -45.71 91.48 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.129 -0.487 . . . . 73.540000000000006 110.931 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 20.8 m-85 -73.07 -34.08 66.02 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.193 -0.458 . . . . 74.019999999999996 110.88 179.911 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 9.6 t0 -76.37 98.43 4.53 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.175 -0.466 . . . . 72.420000000000002 110.897 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 3.0 ttmp? -71.38 -55.73 7.39 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.188 -0.46 . . . . 75.209999999999994 110.903 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 22.3 p-10 -74.82 -10.04 59.12 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.227 -0.442 . . . . 74.409999999999997 110.863 179.867 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 52.25 44.26 57.67 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.732 -0.747 . . . . 72.040000000000006 112.486 -179.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 35.7 p-10 -89.58 -15.8 32.05 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.88 0.371 . . . . 72.140000000000001 110.893 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 103.92 -11.63 52.67 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.716 -0.754 . . . . 71.409999999999997 112.501 -179.906 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 19.8 p -128.01 133.26 49.13 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.736 0.303 . . . . 72.409999999999997 111.144 -179.866 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 24.5 mt -103.94 111.54 33.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.22 -0.445 . . . . 74.140000000000001 111.119 179.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 20.3 p -94.81 -179.73 4.95 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.158 -0.474 . . . . 75.310000000000002 111.138 179.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 65.3 p -61.05 -32.04 71.67 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.185 -0.461 . . . . 75.349999999999994 111.164 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 24.1 tptm -68.31 -50.11 55.76 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.18 -0.463 . . . . 75.129999999999995 110.921 179.867 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -70.33 -32.7 70.55 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.208 -0.451 . . . . 63.509999999999998 110.907 179.937 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -74.14 -41.2 61.93 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.145 -0.48 . . . . 73.409999999999997 110.917 -179.963 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -71.72 -41.01 57.57 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.738 -0.744 . . . . 73.510000000000005 112.478 179.902 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 97.3 m -56.69 -56.43 21.47 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.82 0.343 . . . . 73.549999999999997 111.079 -179.839 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 91.9 t -52.01 -44.78 39.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.227 -0.442 . . . . 74.349999999999994 111.117 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 6.1 mmm -56.38 -34.46 66.7 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.173 -0.467 . . . . 74.430000000000007 110.913 179.874 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 35.9 ttp85 -57.53 -55.26 37.12 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.195 -0.457 . . . . 74.430000000000007 110.899 -179.912 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 3.4 t -59.09 -27.0 65.15 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.205 -0.452 . . . . 75.430000000000007 110.842 -179.825 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 55.7 mt -78.98 -16.46 56.9 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.176 -0.466 . . . . 64.420000000000002 110.957 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 101.55 26.38 7.69 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.751 -0.738 . . . . 41.210000000000001 112.461 179.881 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 17.3 mt-30 -133.38 123.06 24.7 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.801 0.334 . . . . 74.140000000000001 110.92 -179.878 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 2.0 t30 -109.82 76.9 0.99 Allowed Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.6 0.714 . . . . 71.150000000000006 110.9 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.79 161.81 44.51 Favored 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.651 2.234 . . . . 75.329999999999998 112.344 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 34.1 p -100.14 168.74 9.62 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.195 -0.457 . . . . 74.430000000000007 111.12 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 4.4 mp0 -54.43 -51.1 66.0 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.171 -0.468 . . . . 75.310000000000002 110.861 -179.972 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -67.28 -31.5 71.87 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.174 -0.467 . . . . 71.430000000000007 111.143 179.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -65.35 -46.77 78.87 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.199 -0.455 . . . . 73.129999999999995 110.866 -179.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 18.3 mt -67.78 -51.9 43.48 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.188 -0.46 . . . . 74.200000000000003 110.922 -179.964 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 12.5 tp60 -52.91 -28.49 23.59 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.217 -0.447 . . . . 71.319999999999993 110.962 179.901 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -64.42 -49.83 70.0 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.159 -0.473 . . . . 71.329999999999998 110.888 179.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 6.1 ptp -76.35 -35.71 58.57 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.175 -0.466 . . . . 62.229999999999997 110.882 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 81.8 mt -66.09 -38.35 81.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.205 -0.452 . . . . 70.140000000000001 111.138 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 28.0 m-20 -63.59 -43.23 97.55 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.125 -0.489 . . . . 74.349999999999994 110.836 179.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -57.9 -43.54 86.23 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.204 -0.453 . . . . 73.140000000000001 110.856 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 36.0 m -81.56 -13.14 12.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.197 -0.456 . . . . 74.430000000000007 111.124 179.977 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 38.2 t0 -66.89 97.61 0.49 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.198 -0.456 . . . . 73.439999999999998 110.82 179.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.19 -44.31 10.98 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.156 -0.475 . . . . 73.549999999999997 111.132 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 9.3 p-10 -81.74 -0.17 41.76 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.207 -0.451 . . . . 74.219999999999999 110.837 179.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 54.51 57.37 17.7 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.716 -0.754 . . . . 70.400000000000006 112.507 -179.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 52.1 p-10 -114.53 -15.81 11.97 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.859 0.361 . . . . 63.43 110.852 -179.848 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 93.82 15.89 47.39 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.744 -0.741 . . . . 72.120000000000005 112.453 179.963 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 44.6 p -148.84 175.34 11.34 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.763 0.316 . . . . 73.120000000000005 111.13 -179.857 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 19.2 mt -107.84 109.78 29.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.197 -0.456 . . . . 74.010000000000005 111.161 179.897 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.4 t0 -75.28 -172.93 1.88 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.181 -0.463 . . . . 75.409999999999997 110.818 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.515 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 2.5 t80 -65.29 -58.28 12.68 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-O 121.635 0.731 . . . . 75.140000000000001 110.888 -179.933 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . 0.515 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 53.6 Cg_endo -69.76 -26.42 27.6 Favored 'Trans proline' 0 C--N 1.341 0.146 0 C-N-CA 122.649 2.233 . . . . 74.430000000000007 112.364 -179.994 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 20.3 mt-10 -62.07 -40.57 96.26 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.199 -0.455 . . . . 75.109999999999999 110.891 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 17.2 t80 -74.36 -35.86 63.57 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.158 -0.474 . . . . 75.099999999999994 110.903 -179.925 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 33.6 tp -69.92 -53.9 15.79 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.098 -0.501 . . . . 64.340000000000003 110.916 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 14.0 t -53.29 -30.69 40.1 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.175 -0.466 . . . . 73.25 111.155 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 36.2 ttp -58.79 -50.62 73.27 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.222 -0.444 . . . . 74.030000000000001 110.856 179.956 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 1.4 mmt -66.08 -48.81 69.74 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.263 -0.426 . . . . 72.230000000000004 110.891 179.932 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.309 0 CA-C-N 116.262 -0.426 . . . . 72.409999999999997 111.055 179.904 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 56.3 mt . . . . . 0 C--O 1.231 0.101 0 CA-C-O 120.805 0.336 . . . . 75.420000000000002 111.08 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 44.8 ttp180 -53.99 -33.49 57.2 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.188 -0.46 . . . . 75.010000000000005 110.843 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 28.2 tt0 -76.63 -57.45 3.85 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.215 -0.448 . . . . 73.340000000000003 110.858 -179.879 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -53.53 -48.54 68.96 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.15 -0.477 . . . . 61.140000000000001 111.113 179.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 7.0 t80 -52.02 -51.26 58.57 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.21 -0.45 . . . . 71.120000000000005 110.855 -179.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 2.1 tmt_? -62.52 -46.95 86.05 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.166 -0.47 . . . . 74.420000000000002 110.891 -179.892 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 87.8 t -51.88 -47.91 40.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.189 -0.46 . . . . 72.040000000000006 111.143 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 18.6 m-85 -73.57 -26.48 60.85 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.148 -0.478 . . . . 71.239999999999995 110.889 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 31.6 t0 -69.77 95.2 0.87 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.118 -0.492 . . . . 73.5 110.854 179.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -78.65 -52.51 8.33 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.188 -0.46 . . . . 74.319999999999993 110.89 -179.998 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 53.6 p30 -72.66 -9.16 58.28 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.213 -0.448 . . . . 61.539999999999999 110.862 179.91 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 59.87 28.0 65.24 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.711 -0.757 . . . . 53.25 112.492 -179.955 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 46.0 p-10 -82.08 -16.14 51.06 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.871 0.367 . . . . 64.040000000000006 110.894 -179.859 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 88.1 18.66 55.39 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.743 -0.742 . . . . 25.539999999999999 112.507 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 12.9 m-85 -138.89 151.98 47.39 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.862 0.363 . . . . 74.409999999999997 110.911 -179.782 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 70.8 mt -115.73 122.34 69.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.154 -0.476 . . . . 65.439999999999998 111.167 179.907 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 53.4 p -114.81 -172.58 2.15 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.191 -0.459 . . . . 74.319999999999993 110.871 -179.877 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -74.75 -39.77 61.64 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.179 -0.464 . . . . 74.219999999999999 111.154 179.872 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -62.72 -39.98 95.77 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.188 -0.46 . . . . 75.450000000000003 111.09 179.906 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 21.6 mt-10 -76.95 -46.75 23.05 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.217 -0.447 . . . . 75.319999999999993 110.863 -179.89 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 29.7 tp -53.16 -43.97 67.46 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.136 -0.484 . . . . 74.400000000000006 110.926 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 21.7 ttt-85 -51.99 -39.13 58.92 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.175 -0.466 . . . . 70.319999999999993 110.868 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 16.3 t60 -63.3 -35.53 80.67 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.192 -0.458 . . . . 70.120000000000005 110.847 -179.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 90.7 t -70.04 -52.29 32.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.218 -0.446 . . . . 75.099999999999994 111.143 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 1.6 mmt -61.46 -44.68 96.67 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.172 -0.467 . . . . 74.109999999999999 110.849 179.906 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 12.9 p -53.01 -32.78 48.5 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.249 -0.432 . . . . 72.439999999999998 111.17 -179.871 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 8.9 t30 -74.62 -31.01 61.86 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.209 -0.451 . . . . 72.040000000000006 110.868 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 1.1 tt -70.7 -26.07 63.25 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.193 -0.458 . . . . 72.5 110.925 179.966 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 100.12 23.28 10.69 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.758 -0.734 . . . . 71.019999999999996 112.468 179.928 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 54.7 tp10 -104.3 115.58 30.63 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.894 0.378 . . . . 75.329999999999998 110.88 -179.861 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 14.0 pttp -64.82 117.77 8.01 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.156 -0.475 . . . . 75.030000000000001 110.884 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 17.2 mt -146.75 130.66 17.16 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.196 -0.456 . . . . 73.430000000000007 110.912 179.901 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 32.6 p -92.13 170.9 9.46 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.162 -0.472 . . . . 71.120000000000005 111.193 179.964 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 60.3 m-20 -53.24 -43.37 67.28 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.262 -0.426 . . . . 74.0 110.909 179.867 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 16.5 tp10 -65.55 -35.02 79.62 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.187 -0.461 . . . . 73.310000000000002 110.837 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 2.2 tp10 -65.97 -40.72 91.5 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.178 -0.464 . . . . 71.439999999999998 110.859 -179.875 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 30.6 t -61.29 -38.94 80.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.147 -0.479 . . . . 74.019999999999996 111.164 179.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -52.02 -48.92 64.27 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.138 -0.483 . . . . 73.400000000000006 110.836 179.946 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -56.22 -29.3 60.78 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.203 -0.453 . . . . 74.140000000000001 110.859 -179.905 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -73.37 -59.62 2.62 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.191 -0.459 . . . . 65.239999999999995 110.831 179.997 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 33.0 mm -54.06 -35.81 29.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.238 -0.437 . . . . 64.129999999999995 111.134 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 69.2 ttt180 -63.44 -31.77 73.03 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.163 -0.471 . . . . 73.230000000000004 110.921 179.906 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 6.7 tp10 -71.43 -44.34 65.04 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.21 -0.45 . . . . 74.099999999999994 110.934 -179.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -76.06 -26.58 56.68 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.113 -0.494 . . . . 72.019999999999996 111.085 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 43.1 t0 -68.04 87.52 0.26 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.189 -0.46 . . . . 74.420000000000002 110.88 179.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 60.8 mt -79.91 -49.33 19.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.175 -0.466 . . . . 73.310000000000002 111.126 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 18.8 p30 -72.91 -8.7 56.82 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.167 -0.47 . . . . 72.200000000000003 110.841 179.842 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 63.9 44.67 95.73 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.751 -0.738 . . . . 71.200000000000003 112.521 -179.907 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 35.8 p-10 -91.18 -15.88 28.6 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.884 0.373 . . . . 72.030000000000001 110.862 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 104.19 2.33 44.86 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.758 -0.734 . . . . 72.120000000000005 112.457 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 7.2 tt0 -149.19 172.2 15.22 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.775 0.321 . . . . 60.409999999999997 110.935 -179.9 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 136' ' ' VAL . . . . . . . . . . . . . 61.6 t -105.63 109.74 28.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.176 -0.466 . . . . 74.310000000000002 111.142 179.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 23.1 p30 -89.09 165.46 14.49 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.167 -0.47 . . . . 72.030000000000001 110.934 179.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 87.1 t80 -52.05 -47.2 65.21 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.158 -0.474 . . . . 72.310000000000002 110.921 -179.898 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -52.01 -37.98 55.21 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.144 -0.48 . . . . 64.340000000000003 110.881 179.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 19.4 mt-10 -78.39 -47.72 17.03 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.149 -0.478 . . . . 75.129999999999995 110.875 -179.906 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 65.2 t80 -54.33 -36.24 63.55 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.152 -0.476 . . . . 74.120000000000005 110.912 -179.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 90.0 t -70.81 -43.04 77.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.147 -0.479 . . . . 73.450000000000003 111.16 179.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 20.5 tt0 -68.35 -29.98 68.83 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.162 -0.472 . . . . 73.439999999999998 110.872 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 7.9 tpt -72.03 -56.6 5.35 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.254 -0.43 . . . . 64.099999999999994 110.897 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 9.7 ttm -65.91 -26.06 67.44 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.256 -0.429 . . . . 71.230000000000004 110.891 179.927 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 2.1 m . . . . . 0 C--N 1.329 -0.294 0 CA-C-N 116.238 -0.437 . . . . 73.329999999999998 111.135 -179.92 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' M' M ' 15' ' ' LYS . . . . . . . . . . . . . 20.4 mtmm . . . . . 0 C--O 1.231 0.12 0 CA-C-O 120.731 0.301 . . . . 74.030000000000001 110.877 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' M' M ' 16' ' ' TRP . . . . . . . . . . . . . 26.4 m95 -52.28 -43.13 64.27 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.242 -0.435 . . . . 71.219999999999999 110.899 179.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' M' M ' 17' ' ' GLU . . . . . . . . . . . . . 24.5 tt0 -54.48 -27.52 38.39 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.223 -0.444 . . . . 72.129999999999995 110.903 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' M' M ' 18' ' ' LYS . . . . . . . . . . . . . 15.8 ttpt -69.7 -30.6 68.27 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.157 -0.474 . . . . 72.140000000000001 110.899 179.961 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' M' M ' 19' ' ' ILE . . . . . . . . . . . . . 43.9 mt -80.91 -25.02 10.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.22 -0.445 . . . . 74.129999999999995 111.13 179.867 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' M' M ' 20' ' ' ARG . . . . . . . . . . . . . 31.9 ttm180 . . . . . 0 C--N 1.329 -0.297 0 CA-C-N 116.206 -0.452 . . . . 71.420000000000002 110.881 179.973 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' M' M ' 30' ' ' LYS . . . . . . . . . . . . . 12.0 tttp . . . . . 0 C--O 1.232 0.154 0 CA-C-O 120.825 0.345 . . . . 74.5 110.867 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' M' M ' 31' ' ' LEU . . . . . . . . . . . . . 14.2 tp -70.62 -44.63 66.83 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.254 -0.43 . . . . 71.530000000000001 110.921 179.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' M' M ' 32' ' ' LYS . . . . . . . . . . . . . 5.7 mtmt -48.63 -44.87 37.73 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.182 -0.463 . . . . 75.450000000000003 110.894 179.851 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' M' M ' 33' ' ' HIS . . . . . . . . . . . . . 73.9 t60 -50.39 -39.33 46.65 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.227 -0.442 . . . . 74.510000000000005 110.843 179.898 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' M' M ' 34' ' ' ILE . . . . . . . . . . . . . 66.0 mt -50.6 -39.37 17.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.204 -0.453 . . . . 75.129999999999995 111.157 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' M' M ' 35' ' ' VAL . . . . . . . . . . . . . 39.8 t -49.36 -39.8 13.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.179 -0.464 . . . . 74.140000000000001 111.121 179.861 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' M' M ' 36' ' ' TRP . . . . . . . . . . . . . 24.2 m0 -58.71 -39.69 81.53 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.182 -0.463 . . . . 75.420000000000002 110.918 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' M' M ' 37' ' ' ALA . . . . . . . . . . . . . . . -63.87 -18.72 64.45 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.256 -0.429 . . . . 71.310000000000002 111.113 179.829 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' M' M ' 38' ' ' SER . . . . . . . . . . . . . 1.2 m -70.71 -17.91 62.81 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.266 -0.425 . . . . 73.530000000000001 110.873 -179.801 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' M' M ' 39' ' ' ARG . . . . . . . . . . . . . 37.2 mtp180 -53.29 -28.62 28.95 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.129 -0.487 . . . . 75.120000000000005 110.88 -179.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' M' M ' 40' ' ' GLU . . . . . . . . . . . . . 16.0 tp10 -85.98 -47.97 9.11 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.151 -0.477 . . . . 74.329999999999998 110.864 -179.912 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' M' M ' 41' ' ' LEU . . . . . . . . . . . . . 10.5 mt . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 116.152 -0.476 . . . . 75.230000000000004 110.947 -179.969 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.232 0.152 0 CA-C-O 120.775 0.321 . . . . 75.099999999999994 110.86 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 3.3 mp -72.19 -40.06 65.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.21 -0.45 . . . . 75.409999999999997 111.138 179.977 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -53.59 -32.09 49.6 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.215 -0.448 . . . . 75.420000000000002 111.057 179.831 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 27.3 mm-40 -74.79 -52.18 12.15 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.271 -0.422 . . . . 64.329999999999998 110.888 -179.894 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 38.1 m-85 -59.55 -45.97 90.24 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.134 -0.485 . . . . 74.420000000000002 110.889 -179.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 33.0 ttpt -53.87 -35.8 61.96 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.134 -0.485 . . . . 74.150000000000006 110.872 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -65.11 -30.85 71.82 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.269 -0.423 . . . . 75.420000000000002 110.913 179.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -70.68 -48.29 55.5 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.158 -0.474 . . . . 74.519999999999996 111.069 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 89.5 t80 -55.65 -54.24 46.59 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.221 -0.445 . . . . 73.030000000000001 110.887 -179.91 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 27.7 t -53.92 -29.56 42.67 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.109 -0.496 . . . . 74.219999999999999 110.874 -179.792 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 15.6 tp -65.72 -44.32 86.41 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.094 -0.503 . . . . 74.019999999999996 110.914 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 56.0 m-85 -75.71 -25.89 57.04 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.153 -0.476 . . . . 75.530000000000001 110.888 179.935 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 12.8 t0 -79.53 98.53 6.88 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.16 -0.473 . . . . 64.310000000000002 110.889 179.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 10.4 ttpp -67.11 -50.75 60.4 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.216 -0.447 . . . . 75.200000000000003 110.903 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 24.0 p-10 -81.0 -10.16 59.75 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.206 -0.452 . . . . 74.420000000000002 110.919 179.847 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 51.73 42.48 52.61 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.728 -0.749 . . . . 53.100000000000001 112.457 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 22.9 p-10 -88.51 -15.79 34.36 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.85 0.357 . . . . 74.109999999999999 110.854 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 102.18 17.64 19.65 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.715 -0.755 . . . . 42.409999999999997 112.477 -179.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -154.64 130.79 10.31 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.777 0.322 . . . . 73.430000000000007 111.127 -179.866 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 23.5 mt -97.73 122.38 49.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.167 -0.469 . . . . 72.219999999999999 111.12 179.915 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 21.4 p -105.48 176.72 5.07 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.166 -0.47 . . . . 63.130000000000003 111.142 179.958 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 72.3 p -61.18 -29.34 69.74 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.239 -0.437 . . . . 71.140000000000001 111.129 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 28.4 mmtp -72.7 -49.97 27.9 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.202 -0.454 . . . . 73.140000000000001 110.883 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -68.93 -32.68 72.48 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.21 -0.45 . . . . 75.030000000000001 110.896 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -71.52 -43.35 66.62 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.134 -0.484 . . . . 70.129999999999995 110.882 -179.978 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -70.26 -28.14 71.84 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.73 -0.747 . . . . 53.329999999999998 112.492 179.903 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 92.9 m -71.91 -58.21 3.65 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.826 0.346 . . . . 64.400000000000006 111.114 -179.851 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 96.0 t -51.62 -49.46 34.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.252 -0.431 . . . . 73.430000000000007 111.09 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 6.4 ttt -60.33 -39.31 86.6 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.199 -0.455 . . . . 72.430000000000007 110.868 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 51.4 ttp85 -52.74 -43.2 65.58 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.243 -0.435 . . . . 73.040000000000006 110.891 -179.944 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.7 t -70.28 -25.23 63.24 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.222 -0.445 . . . . 75.099999999999994 110.861 -179.8 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 57.1 mt -76.15 -20.92 57.14 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.108 -0.496 . . . . 74.109999999999999 110.932 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 101.48 30.01 6.07 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.771 -0.728 . . . . 71.150000000000006 112.511 179.916 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 15.4 mm-40 -128.9 122.56 30.54 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.829 0.347 . . . . 73.409999999999997 110.882 -179.897 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 33.7 t-20 -109.93 80.68 1.82 Allowed Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.589 0.709 . . . . 54.219999999999999 110.89 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.74 168.03 22.71 Favored 'Trans proline' 0 C--O 1.231 0.158 0 C-N-CA 122.671 2.247 . . . . 73.109999999999999 112.346 179.937 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 18.0 p -93.05 158.74 15.63 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.187 -0.46 . . . . 75.329999999999998 111.105 -179.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.3 pt-20 -51.66 -45.0 63.23 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.197 -0.456 . . . . 74.430000000000007 110.893 179.993 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -72.29 -31.32 65.62 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.16 -0.473 . . . . 70.420000000000002 111.088 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -69.98 -42.23 73.38 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.208 -0.451 . . . . 74.209999999999994 110.838 -179.853 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 15.1 mt -59.57 -50.98 71.79 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.187 -0.46 . . . . 71.219999999999999 110.932 179.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -71.91 -28.36 63.43 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.186 -0.461 . . . . 65.209999999999994 110.94 179.923 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 7.8 t0 -56.49 -49.8 73.64 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.18 -0.464 . . . . 74.400000000000006 110.813 179.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 6.7 ptp -69.49 -37.67 77.34 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.216 -0.447 . . . . 74.239999999999995 110.895 -179.957 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 96.5 mt -62.08 -52.48 59.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.191 -0.458 . . . . 73.409999999999997 111.126 179.928 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -55.06 -32.95 62.31 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.17 -0.468 . . . . 64.319999999999993 110.857 179.952 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -60.4 -55.29 35.36 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.185 -0.461 . . . . 74.129999999999995 110.852 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 17.2 m -77.12 -13.1 14.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.215 -0.448 . . . . 74.140000000000001 111.108 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 41.9 t0 -66.74 96.39 0.4 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.192 -0.458 . . . . 70.129999999999995 110.879 179.916 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.25 -36.81 16.52 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.217 -0.447 . . . . 71.319999999999993 111.08 179.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -86.45 -0.23 55.57 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.177 -0.465 . . . . 74.540000000000006 110.894 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 51.93 60.99 6.89 Favored Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.747 -0.739 . . . . 75.5 112.52 -179.946 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 51.5 p-10 -114.61 -15.89 11.92 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.814 0.34 . . . . 74.430000000000007 110.841 -179.822 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 93.82 17.93 39.48 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.709 -0.758 . . . . 74.120000000000005 112.446 179.941 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 70.0 p -151.07 174.29 13.35 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.758 0.313 . . . . 74.040000000000006 111.146 -179.819 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 22.6 mt -104.84 110.93 32.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.279 -0.419 . . . . 75.329999999999998 111.163 179.897 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -75.12 -172.98 1.84 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.219 -0.446 . . . . 74.010000000000005 110.873 179.874 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.524 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 2.5 t80 -65.52 -58.31 12.18 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-O 121.644 0.735 . . . . 74.409999999999997 110.947 -179.916 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . 0.524 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 53.7 Cg_endo -69.77 -26.98 27.0 Favored 'Trans proline' 0 C--N 1.341 0.16 0 C-N-CA 122.636 2.224 . . . . 74.329999999999998 112.38 179.962 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -60.91 -41.41 96.04 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.186 -0.461 . . . . 75.349999999999994 110.879 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 8.3 t80 -74.58 -35.72 63.03 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.154 -0.476 . . . . 74.239999999999995 110.909 -179.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 18.6 tp -68.76 -54.13 17.82 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.113 -0.494 . . . . 74.409999999999997 110.903 -179.976 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 14.6 t -52.97 -28.18 22.55 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.183 -0.462 . . . . 73.329999999999998 111.141 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 43.2 ttp -64.92 -48.35 74.45 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.239 -0.437 . . . . 74.239999999999995 110.885 179.881 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -63.34 -38.21 90.26 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.248 -0.433 . . . . 73.439999999999998 110.876 179.944 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.278 0 CA-C-N 116.268 -0.424 . . . . 65.209999999999994 111.098 179.929 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 78.8 mt . . . . . 0 C--O 1.231 0.1 0 CA-C-O 120.82 0.343 . . . . 75.140000000000001 111.109 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.79 -53.34 13.68 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.182 -0.463 . . . . 75.510000000000005 110.889 179.97 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 11.6 tt0 -51.9 -46.37 64.54 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.205 -0.452 . . . . 72.219999999999999 110.874 -179.942 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -56.18 -41.44 75.52 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.182 -0.463 . . . . 74.219999999999999 111.08 179.936 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 9.4 t80 -54.74 -36.47 64.82 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.256 -0.429 . . . . 74.239999999999995 110.863 -179.899 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.76 -47.09 64.25 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.114 -0.494 . . . . 72.340000000000003 110.86 -179.888 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 84.5 t -53.22 -28.6 15.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.204 -0.453 . . . . 71.150000000000006 111.13 179.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 9.4 m-85 -94.9 -28.2 15.32 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.149 -0.478 . . . . 71.540000000000006 110.852 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 37.9 t0 -81.48 81.72 7.51 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.169 -0.469 . . . . 63.140000000000001 110.848 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 4.5 mptp? -76.46 -43.78 38.43 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.228 -0.442 . . . . 75.409999999999997 110.87 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 10.0 p30 -72.87 -9.14 58.36 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.215 -0.448 . . . . 63.219999999999999 110.837 179.888 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 60.34 30.67 71.77 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.717 -0.754 . . . . 73.430000000000007 112.489 -179.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 33.8 p-10 -82.35 -16.15 50.23 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.927 0.394 . . . . 54.32 110.922 -179.879 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 80.37 18.73 70.67 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.7 -0.762 . . . . 72.549999999999997 112.53 179.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 22.8 m-85 -143.52 142.56 31.18 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.859 0.361 . . . . 73.420000000000002 110.934 -179.827 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 68.5 mt -103.92 119.46 52.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.173 -0.467 . . . . 74.530000000000001 111.106 179.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 8.5 p -105.05 -175.42 2.79 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.132 -0.485 . . . . 74.209999999999994 110.865 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -74.59 -28.09 60.76 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.104 -0.498 . . . . 43.310000000000002 111.083 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -71.89 -38.34 70.01 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.229 -0.441 . . . . 72.040000000000006 111.13 179.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -74.06 -44.59 53.69 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.196 -0.457 . . . . 74.129999999999995 110.903 -179.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 23.3 tp -52.88 -33.74 51.43 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.162 -0.472 . . . . 75.099999999999994 110.923 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 53.3 ttp85 -70.57 -44.42 67.42 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.164 -0.471 . . . . 74.219999999999999 110.905 179.914 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 2.7 t60 -54.59 -37.24 65.3 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.172 -0.467 . . . . 64.25 110.891 179.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 38.4 t -73.47 -33.18 39.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.191 -0.459 . . . . 72.120000000000005 111.123 179.941 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 15.4 mmt -70.38 -32.46 70.13 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.186 -0.461 . . . . 65.200000000000003 110.902 179.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 20.4 p -60.47 -43.02 97.35 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.226 -0.443 . . . . 74.450000000000003 111.161 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 29.9 m-20 -74.66 -30.18 61.51 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.251 -0.431 . . . . 75.239999999999995 110.901 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 14.9 mt -70.69 -26.04 63.25 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.175 -0.466 . . . . 73.140000000000001 110.927 179.928 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 100.74 30.9 5.94 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.71 -0.757 . . . . 53.240000000000002 112.525 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -125.04 109.97 13.59 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.931 0.396 . . . . 72.200000000000003 110.888 -179.856 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 7.9 ptmm? -75.28 125.97 30.06 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.168 -0.469 . . . . 74.040000000000006 110.889 179.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 36.2 mt -145.12 163.35 34.58 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.201 -0.454 . . . . 72.209999999999994 110.94 179.903 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 23.7 p -118.73 173.7 6.71 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.219 -0.446 . . . . 72.129999999999995 111.101 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -58.01 -38.61 76.48 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.202 -0.454 . . . . 73.310000000000002 110.872 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 13.4 tt0 -71.96 -33.6 68.32 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.207 -0.451 . . . . 71.219999999999999 110.901 -179.92 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -71.1 -44.49 65.54 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.151 -0.477 . . . . 74.209999999999994 110.856 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 39.6 t -58.93 -31.6 45.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.203 -0.453 . . . . 75.120000000000005 111.15 179.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -52.01 -42.3 62.92 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.172 -0.467 . . . . 64.120000000000005 110.863 179.906 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 68.4 tt0 -57.81 -31.4 66.56 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.222 -0.445 . . . . 75.519999999999996 110.908 -179.921 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 30.7 mtp -76.07 -58.76 3.09 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.101 -0.499 . . . . 74.219999999999999 110.897 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 35.9 mm -53.9 -35.71 28.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.215 -0.448 . . . . 73.310000000000002 111.149 179.932 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 38.8 ttt180 -63.42 -31.85 73.13 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.175 -0.466 . . . . 74.109999999999999 110.91 179.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 -74.58 -52.38 11.95 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.198 -0.456 . . . . 72.030000000000001 110.88 -179.94 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -65.34 -34.43 78.3 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.137 -0.483 . . . . 54.299999999999997 111.078 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 49.3 t0 -68.43 86.72 0.3 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.184 -0.462 . . . . 72.239999999999995 110.859 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 59.0 mt -79.82 -46.22 22.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.181 -0.463 . . . . 71.540000000000006 111.135 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 21.2 p30 -72.78 -8.69 56.65 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.202 -0.454 . . . . 73.519999999999996 110.869 179.845 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 62.79 42.71 99.64 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.738 -0.744 . . . . 64.310000000000002 112.46 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 34.7 p-10 -87.75 -15.9 35.71 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.867 0.365 . . . . 74.010000000000005 110.914 179.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 104.1 2.34 45.15 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.719 -0.753 . . . . 72.430000000000007 112.473 -179.941 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 4.2 tt0 -149.21 172.23 15.18 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.808 0.337 . . . . 64.400000000000006 110.921 -179.858 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 136' ' ' VAL . . . . . . . . . . . . . 98.7 t -106.91 109.98 30.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.185 -0.461 . . . . 73.420000000000002 111.132 179.913 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 20.2 p30 -90.99 165.12 13.71 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.159 -0.473 . . . . 73.409999999999997 110.885 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 34.2 t80 -52.16 -46.76 65.6 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.155 -0.475 . . . . 72.420000000000002 110.919 -179.912 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 19.0 tp10 -52.0 -40.15 60.54 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.15 -0.477 . . . . 74.209999999999994 110.835 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 22.9 mt-10 -78.4 -32.68 48.91 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.206 -0.452 . . . . 74.209999999999994 110.916 -179.935 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 65.5 t80 -67.8 -39.01 84.03 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.152 -0.476 . . . . 74.140000000000001 110.89 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 95.7 t -71.25 -50.85 38.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.148 -0.478 . . . . 72.239999999999995 111.142 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 14.9 tt0 -61.32 -38.68 87.77 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.221 -0.445 . . . . 74.109999999999999 110.898 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 15.4 tpt -68.9 -55.58 10.6 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.218 -0.446 . . . . 72.319999999999993 110.862 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 12.5 ttm -60.54 -29.54 69.2 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.234 -0.439 . . . . 73.420000000000002 110.921 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 1.8 m . . . . . 0 C--N 1.33 -0.267 0 CA-C-N 116.192 -0.458 . . . . 64.450000000000003 111.143 -179.927 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' M' M ' 15' ' ' LYS . . . . . . . . . . . . . 41.1 mttp . . . . . 0 C--O 1.23 0.078 0 CA-C-O 120.762 0.315 . . . . 71.140000000000001 110.885 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' M' M ' 16' ' ' TRP . . . . . . . . . . . . . 12.0 m95 -53.01 -40.56 63.93 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.233 -0.439 . . . . 73.340000000000003 110.912 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' M' M ' 17' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -56.35 -26.05 51.32 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.267 -0.424 . . . . 62.039999999999999 110.923 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' M' M ' 18' ' ' LYS . . . . . . . . . . . . . 29.1 tttp -78.69 -26.58 44.95 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.146 -0.479 . . . . 74.239999999999995 110.908 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' M' M ' 19' ' ' ILE . . . . . . . . . . . . . 39.3 mt -87.79 -25.18 6.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.226 -0.443 . . . . 74.549999999999997 111.1 179.88 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' M' M ' 20' ' ' ARG . . . . . . . . . . . . . 25.5 ttp180 . . . . . 0 C--N 1.329 -0.326 0 CA-C-N 116.228 -0.442 . . . . 75.420000000000002 110.864 179.962 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' M' M ' 30' ' ' LYS . . . . . . . . . . . . . 15.8 tttp . . . . . 0 C--O 1.232 0.153 0 CA-C-O 120.786 0.327 . . . . 70.209999999999994 110.859 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' M' M ' 31' ' ' LEU . . . . . . . . . . . . . 15.5 tp -106.77 -49.77 3.24 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.233 -0.44 . . . . 74.230000000000004 110.955 179.918 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' M' M ' 32' ' ' LYS . . . . . . . . . . . . . 39.7 tttm -48.23 -45.78 34.59 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.158 -0.473 . . . . 73.519999999999996 110.912 179.789 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' M' M ' 33' ' ' HIS . . . . . . . . . . . . . 19.8 t-160 -51.21 -39.3 56.21 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.257 -0.429 . . . . 73.439999999999998 110.88 179.881 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' M' M ' 34' ' ' ILE . . . . . . . . . . . . . 72.5 mt -51.18 -37.78 18.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.196 -0.456 . . . . 65.439999999999998 111.186 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' M' M ' 35' ' ' VAL . . . . . . . . . . . . . 46.3 t -49.11 -39.11 12.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.157 -0.474 . . . . 72.310000000000002 111.133 179.86 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' M' M ' 36' ' ' TRP . . . . . . . . . . . . . 19.5 m0 -58.44 -40.03 81.47 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.154 -0.475 . . . . 74.25 110.892 179.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' M' M ' 37' ' ' ALA . . . . . . . . . . . . . . . -63.2 -18.7 63.78 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.191 -0.459 . . . . 75.310000000000002 111.097 179.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' M' M ' 38' ' ' SER . . . . . . . . . . . . . 1.5 m -68.24 -18.07 64.46 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.185 -0.462 . . . . 70.450000000000003 110.853 -179.727 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' M' M ' 39' ' ' ARG . . . . . . . . . . . . . 41.2 mtp180 -52.49 -29.56 25.54 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.087 -0.506 . . . . 61.43 110.862 -179.946 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' M' M ' 40' ' ' GLU . . . . . . . . . . . . . 21.7 mt-10 -82.06 -48.05 11.87 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.178 -0.465 . . . . 72.519999999999996 110.892 -179.915 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' M' M ' 41' ' ' LEU . . . . . . . . . . . . . 9.8 mt . . . . . 0 C--N 1.329 -0.3 0 CA-C-N 116.184 -0.462 . . . . 72.340000000000003 110.929 179.998 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 35.0 tt0 . . . . . 0 C--O 1.232 0.143 0 CA-C-O 120.746 0.308 . . . . 64.230000000000004 110.878 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 62.1 mt -72.53 -37.68 57.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.246 -0.434 . . . . 74.510000000000005 111.143 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -56.03 -45.23 79.23 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.115 -0.493 . . . . 62.149999999999999 111.082 179.872 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -66.44 -32.2 73.42 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.2 -0.455 . . . . 74.25 110.921 -179.958 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 9.4 m-85 -73.44 -45.93 51.44 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.119 -0.491 . . . . 74.519999999999996 110.888 -179.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 34.9 ttmt -56.76 -37.61 71.29 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.172 -0.467 . . . . 72.25 110.907 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -59.92 -30.69 69.22 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.272 -0.422 . . . . 75.540000000000006 110.891 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -67.26 -42.39 83.97 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.174 -0.466 . . . . 71.109999999999999 111.119 179.933 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 40.8 t80 -58.16 -54.13 50.39 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.238 -0.437 . . . . 74.420000000000002 110.891 -179.928 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 6.8 t -52.26 -31.09 30.84 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.146 -0.479 . . . . 75.239999999999995 110.833 -179.814 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 16.2 tp -65.74 -49.34 68.78 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.187 -0.461 . . . . 72.120000000000005 110.919 179.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 33.1 m-85 -72.28 -25.97 61.8 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.178 -0.464 . . . . 75.519999999999996 110.853 179.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 13.5 t0 -86.05 98.53 10.9 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.163 -0.472 . . . . 74.209999999999994 110.901 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 6.7 tppt? -68.96 -52.78 25.42 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.23 -0.441 . . . . 71.340000000000003 110.869 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 24.1 p-10 -77.08 -10.08 59.15 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.241 -0.436 . . . . 75.310000000000002 110.913 179.861 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 52.11 48.4 52.77 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.773 -0.727 . . . . 64.099999999999994 112.433 -179.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 31.8 p-10 -88.53 -15.71 34.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.818 0.342 . . . . 74.340000000000003 110.889 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 105.41 -11.64 47.25 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.718 -0.753 . . . . 72.299999999999997 112.5 -179.925 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 4.2 p -132.13 130.7 41.5 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.712 0.292 . . . . 72.310000000000002 111.151 -179.873 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 23.2 mt -89.7 114.01 26.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.239 -0.437 . . . . 71.099999999999994 111.117 179.906 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 44.8 p -93.38 170.67 9.44 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.216 -0.447 . . . . 74.530000000000001 111.113 179.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 82.4 p -58.17 -34.47 70.35 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.213 -0.449 . . . . 72.25 111.119 -179.955 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 30.8 tptt -79.84 -50.13 10.96 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.213 -0.448 . . . . 74.340000000000003 110.922 179.882 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 60.1 mt-10 -59.03 -34.69 72.2 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.189 -0.46 . . . . 74.019999999999996 110.928 179.931 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.1 tt -74.22 -55.68 5.78 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.138 -0.483 . . . . 73.5 110.894 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -52.3 -27.87 25.64 Favored Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.752 -0.737 . . . . 73.340000000000003 112.485 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 96.3 m -58.5 -58.06 10.2 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.838 0.352 . . . . 64.0 111.131 -179.821 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 98.7 t -56.21 -47.55 80.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.225 -0.443 . . . . 73.400000000000006 111.084 179.933 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 7.0 mtp -51.86 -41.36 61.8 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.201 -0.454 . . . . 72.030000000000001 110.879 179.897 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 27.9 ttt180 -53.09 -45.44 68.2 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.244 -0.435 . . . . 74.519999999999996 110.829 -179.896 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.8 p -61.25 -26.14 67.55 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.247 -0.433 . . . . 64.340000000000003 110.843 -179.739 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 18.0 mt -89.86 -16.35 30.27 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.163 -0.472 . . . . 72.450000000000003 110.889 -180.0 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 101.44 27.34 7.26 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.725 -0.75 . . . . 64.420000000000002 112.467 179.853 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 22.0 mm100 -116.88 106.5 13.52 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.78 0.324 . . . . 75.420000000000002 110.901 -179.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 14.6 t-20 -109.99 76.56 1.0 Allowed Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 121.637 0.732 . . . . 74.209999999999994 110.865 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.75 168.09 22.55 Favored 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.656 2.237 . . . . 72.310000000000002 112.334 179.925 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 19.0 p -87.6 156.67 19.39 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.195 -0.457 . . . . 63.130000000000003 111.162 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -51.8 -41.77 61.96 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.205 -0.452 . . . . 61.32 110.893 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.23 -32.16 64.58 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.187 -0.46 . . . . 74.430000000000007 111.098 179.901 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 68.3 tt0 -68.86 -50.08 52.83 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.222 -0.445 . . . . 64.230000000000004 110.915 -179.887 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 16.0 mt -55.12 -45.24 75.54 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.087 -0.506 . . . . 64.239999999999995 110.922 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 3.8 tm0? -71.77 -28.68 63.8 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.166 -0.47 . . . . 73.109999999999999 110.895 179.917 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -63.71 -49.76 71.82 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.231 -0.44 . . . . 74.450000000000003 110.901 179.946 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 5.5 ptp -66.2 -37.47 85.68 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.19 -0.459 . . . . 75.239999999999995 110.872 179.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 66.0 mt -67.07 -38.1 80.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.203 -0.453 . . . . 73.430000000000007 111.059 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 14.3 m-20 -59.58 -37.63 79.05 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.231 -0.44 . . . . 75.299999999999997 110.881 179.935 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 70.0 mm-40 -61.98 -47.95 82.52 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.196 -0.456 . . . . 61.409999999999997 110.897 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 16.9 m -77.81 -15.24 14.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.141 -0.482 . . . . 64.340000000000003 111.099 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 37.3 t0 -66.8 94.26 0.3 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.223 -0.444 . . . . 74.200000000000003 110.861 179.929 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.27 -35.92 16.99 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.182 -0.463 . . . . 72.519999999999996 111.11 179.945 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 1.9 p-10 -88.67 -0.17 57.02 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.235 -0.439 . . . . 72.349999999999994 110.867 179.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 54.5 60.09 9.12 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.746 -0.74 . . . . 61.549999999999997 112.5 -179.913 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 50.9 p-10 -114.6 -15.79 11.94 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.912 0.386 . . . . 72.439999999999998 110.91 -179.921 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 93.4 13.26 56.06 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.771 -0.728 . . . . 53.130000000000003 112.504 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 70.3 p -150.65 171.93 16.36 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.732 0.301 . . . . 75.5 111.157 -179.88 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 16.1 mt -96.1 115.17 34.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.223 -0.444 . . . . 73.430000000000007 111.1 179.947 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.7 t0 -78.78 -175.26 4.35 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.18 -0.464 . . . . 75.329999999999998 110.884 179.866 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.519 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 2.5 t80 -63.5 -58.37 15.75 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.634 0.73 . . . . 72.129999999999995 110.898 -179.888 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . 0.519 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 53.6 Cg_endo -69.79 -30.64 21.82 Favored 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.624 2.216 . . . . 74.239999999999995 112.343 -179.994 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 55.8 mt-10 -59.0 -40.77 85.91 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.268 -0.424 . . . . 71.329999999999998 110.909 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 12.7 t80 -74.17 -35.68 64.02 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.171 -0.468 . . . . 73.409999999999997 110.911 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 27.6 tp -68.4 -53.88 20.86 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.141 -0.482 . . . . 70.299999999999997 110.937 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 15.3 t -53.63 -29.17 36.88 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.184 -0.462 . . . . 74.040000000000006 111.133 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 35.4 ttp -62.78 -43.49 98.66 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.237 -0.438 . . . . 73.310000000000002 110.856 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 3.3 mmt -71.4 -29.72 65.25 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.236 -0.438 . . . . 71.310000000000002 110.9 179.927 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.309 0 CA-C-N 116.226 -0.443 . . . . 73.150000000000006 111.136 179.915 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 70.6 mt . . . . . 0 C--O 1.232 0.142 0 CA-C-O 120.813 0.34 . . . . 75.439999999999998 111.181 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 45.7 ttp180 -62.5 -28.32 69.75 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.176 -0.465 . . . . 75.239999999999995 110.924 179.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -76.13 -46.87 26.63 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.207 -0.451 . . . . 73.510000000000005 110.922 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -63.75 -42.68 97.8 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.171 -0.468 . . . . 74.25 111.1 179.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 9.9 t80 -52.02 -50.69 60.9 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.211 -0.45 . . . . 74.319999999999993 110.88 -179.905 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 32.1 ttm180 -62.75 -35.98 81.56 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.141 -0.481 . . . . 74.340000000000003 110.858 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 85.3 t -63.91 -42.67 96.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.186 -0.461 . . . . 74.409999999999997 111.134 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 9.2 m-85 -78.2 -31.18 49.31 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.157 -0.474 . . . . 75.439999999999998 110.899 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 22.7 t0 -61.25 96.91 0.06 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.168 -0.469 . . . . 75.450000000000003 110.894 179.98 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 13.4 mmmt -77.35 -53.34 7.8 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.23 -0.441 . . . . 73.140000000000001 110.872 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 16.5 p30 -74.25 -9.19 58.36 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.226 -0.443 . . . . 73.120000000000005 110.838 179.902 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 59.69 25.86 61.78 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.75 -0.738 . . . . 54.100000000000001 112.465 -179.917 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 40.5 p-10 -82.11 -16.16 50.91 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.824 0.345 . . . . 73.450000000000003 110.901 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 86.7 18.7 57.93 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.735 -0.745 . . . . 73.219999999999999 112.485 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 13.0 m-85 -137.85 134.27 34.9 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.888 0.375 . . . . 73.109999999999999 110.933 -179.816 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 71.4 mt -100.04 125.6 53.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.098 -0.501 . . . . 73.430000000000007 111.102 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 86.0 p -109.17 -172.81 2.12 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.198 -0.455 . . . . 72.030000000000001 110.885 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -72.74 -37.11 67.81 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.114 -0.494 . . . . 52.439999999999998 111.074 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -70.24 -49.92 45.1 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.238 -0.437 . . . . 52.240000000000002 111.101 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -62.56 -48.5 79.19 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.227 -0.442 . . . . 75.430000000000007 110.867 -179.911 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 30.4 tp -56.35 -26.85 54.06 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.169 -0.468 . . . . 74.540000000000006 110.904 -179.933 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 17.9 ttm180 -73.35 -29.04 62.39 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.175 -0.466 . . . . 74.329999999999998 110.875 179.938 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 19.8 t60 -66.95 -34.69 78.32 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.191 -0.459 . . . . 73.099999999999994 110.871 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 40.9 t -74.49 -39.58 47.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.17 -0.468 . . . . 72.319999999999993 111.168 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 2.3 mmt -73.87 -38.69 64.34 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.164 -0.471 . . . . 72.349999999999994 110.913 179.857 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 3.0 p -54.12 -32.75 56.0 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.209 -0.45 . . . . 74.430000000000007 111.165 -179.935 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -74.68 -28.35 60.79 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.218 -0.446 . . . . 74.019999999999996 110.887 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -70.68 -25.95 63.21 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.19 -0.459 . . . . 74.129999999999995 110.933 179.947 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 100.84 19.4 17.51 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.73 -0.748 . . . . 62.530000000000001 112.518 179.93 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -102.81 127.9 49.79 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.873 0.368 . . . . 73.400000000000006 110.896 -179.874 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 34.0 mttp -80.83 117.51 21.55 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.186 -0.461 . . . . 73.319999999999993 110.929 179.945 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 15.3 mt -130.02 113.34 14.44 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.253 -0.43 . . . . 75.030000000000001 110.909 179.933 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 75.1 p -81.91 171.22 14.71 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.17 -0.468 . . . . 73.120000000000005 111.156 179.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 46.7 m-20 -52.01 -36.68 50.78 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.238 -0.437 . . . . 74.040000000000006 110.826 179.9 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -75.23 -33.4 61.35 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.163 -0.471 . . . . 73.109999999999999 110.928 -179.91 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -69.63 -42.19 74.62 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.111 -0.495 . . . . 64.140000000000001 110.906 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 21.8 t -61.03 -38.62 79.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.163 -0.471 . . . . 74.540000000000006 111.119 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 50.0 t0 -56.88 -45.48 82.49 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.212 -0.449 . . . . 72.439999999999998 110.9 179.901 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 15.5 tm-20 -57.51 -34.26 68.91 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.193 -0.458 . . . . 73.319999999999993 110.839 -179.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 27.1 mtp -70.69 -59.56 2.75 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.2 -0.454 . . . . 71.510000000000005 110.862 -179.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 36.3 mm -53.97 -35.5 28.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.211 -0.449 . . . . 74.310000000000002 111.134 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 56.5 ttt85 -63.07 -31.84 73.08 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.171 -0.468 . . . . 75.549999999999997 110.863 179.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -75.11 -52.38 11.14 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.148 -0.478 . . . . 64.019999999999996 110.9 -179.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -64.88 -34.41 78.32 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.168 -0.469 . . . . 73.25 111.126 179.909 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 49.0 t0 -68.37 86.9 0.29 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.197 -0.456 . . . . 74.099999999999994 110.853 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 64.7 mt -79.85 -46.61 22.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.178 -0.465 . . . . 74.120000000000005 111.145 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 21.5 p30 -72.63 -8.69 56.53 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.175 -0.466 . . . . 74.519999999999996 110.865 179.848 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 62.86 43.02 99.54 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.73 -0.748 . . . . 72.340000000000003 112.497 -179.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 34.5 p-10 -88.51 -15.91 34.05 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.865 0.364 . . . . 64.329999999999998 110.869 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 104.14 2.35 45.03 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.768 -0.729 . . . . 64.150000000000006 112.468 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 5.3 tt0 -149.21 172.29 15.08 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.814 0.34 . . . . 74.239999999999995 110.913 -179.902 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 136' ' ' VAL . . . . . . . . . . . . . 72.4 t -106.83 109.28 27.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.185 -0.462 . . . . 75.239999999999995 111.111 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 20.9 p30 -91.27 164.79 13.75 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.159 -0.473 . . . . 50.240000000000002 110.859 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 37.5 t80 -52.25 -46.22 65.68 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.185 -0.462 . . . . 65.409999999999997 110.923 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -51.91 -39.74 59.58 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.117 -0.492 . . . . 72.239999999999995 110.868 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 26.1 mt-10 -78.38 -37.36 44.32 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.172 -0.467 . . . . 52.530000000000001 110.887 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 36.8 t80 -63.95 -39.61 94.55 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.135 -0.484 . . . . 74.430000000000007 110.855 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 90.9 t -63.74 -50.72 76.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.175 -0.466 . . . . 74.019999999999996 111.119 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 43.3 tt0 -70.8 -23.38 62.36 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.181 -0.463 . . . . 73.230000000000004 110.927 -179.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 11.7 tpt -75.03 -18.73 60.29 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.157 -0.474 . . . . 74.439999999999998 110.904 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 5.8 ttm -98.2 -32.98 11.3 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.225 -0.443 . . . . 72.019999999999996 110.856 179.954 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 5.0 t . . . . . 0 C--N 1.329 -0.291 0 CA-C-N 116.256 -0.429 . . . . 51.229999999999997 111.128 -179.918 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' M' M ' 15' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.231 0.083 0 CA-C-O 120.815 0.341 . . . . 74.219999999999999 110.939 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' M' M ' 16' ' ' TRP . . . . . . . . . . . . . 3.1 m95 -51.94 -38.59 57.04 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.222 -0.445 . . . . 72.540000000000006 110.865 179.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' M' M ' 17' ' ' GLU . . . . . . . . . . . . . 58.4 tt0 -56.07 -30.91 62.68 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.251 -0.431 . . . . 74.140000000000001 110.944 -179.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' M' M ' 18' ' ' LYS . . . . . . . . . . . . . 6.5 tppt? -52.02 -30.41 25.28 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.13 -0.486 . . . . 73.439999999999998 110.892 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' M' M ' 19' ' ' ILE . . . . . . . . . . . . . 64.1 mt -91.31 -24.54 5.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.167 -0.47 . . . . 74.200000000000003 111.088 179.901 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' M' M ' 20' ' ' ARG . . . . . . . . . . . . . 12.1 ttm180 . . . . . 0 C--N 1.329 -0.288 0 CA-C-N 116.204 -0.453 . . . . 73.319999999999993 110.835 -179.976 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' M' M ' 30' ' ' LYS . . . . . . . . . . . . . 14.5 mtmm . . . . . 0 C--O 1.231 0.129 0 CA-C-O 120.817 0.341 . . . . 73.310000000000002 110.889 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' M' M ' 31' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -96.99 -28.05 14.34 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.247 -0.433 . . . . 74.150000000000006 110.909 179.927 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' M' M ' 32' ' ' LYS . . . . . . . . . . . . . 7.5 tttp -49.2 -46.42 45.67 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.205 -0.452 . . . . 75.340000000000003 110.889 179.825 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' M' M ' 33' ' ' HIS . . . . . . . . . . . . . 22.1 t-160 -50.95 -37.18 42.87 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.239 -0.437 . . . . 72.239999999999995 110.842 179.91 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' M' M ' 34' ' ' ILE . . . . . . . . . . . . . 47.6 mm -50.33 -39.57 17.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.221 -0.445 . . . . 75.0 111.157 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' M' M ' 35' ' ' VAL . . . . . . . . . . . . . 46.9 t -48.86 -40.18 12.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.131 -0.486 . . . . 72.209999999999994 111.132 179.818 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' M' M ' 36' ' ' TRP . . . . . . . . . . . . . 23.6 m0 -58.62 -39.91 81.82 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.177 -0.465 . . . . 75.450000000000003 110.956 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' M' M ' 37' ' ' ALA . . . . . . . . . . . . . . . -63.69 -18.66 64.21 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.198 -0.455 . . . . 73.230000000000004 111.141 179.845 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' M' M ' 38' ' ' SER . . . . . . . . . . . . . 13.2 m -69.48 -17.95 63.66 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.199 -0.455 . . . . 72.409999999999997 110.876 -179.811 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' M' M ' 39' ' ' ARG . . . . . . . . . . . . . 25.8 mmm180 -63.11 -24.18 67.78 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.122 -0.49 . . . . 75.25 110.831 -179.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' M' M ' 40' ' ' GLU . . . . . . . . . . . . . 17.3 tt0 -80.72 -48.07 13.07 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.212 -0.449 . . . . 74.010000000000005 110.905 -179.946 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' M' M ' 41' ' ' LEU . . . . . . . . . . . . . 19.7 mt . . . . . 0 C--N 1.328 -0.336 0 CA-C-N 116.168 -0.469 . . . . 74.299999999999997 110.913 -179.992 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 28.5 tp60 . . . . . 0 C--O 1.231 0.112 0 CA-C-O 120.787 0.327 . . . . 74.200000000000003 110.915 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 54.3 mt -69.16 -37.25 76.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.205 -0.452 . . . . 74.400000000000006 111.114 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -51.95 -39.06 58.65 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.161 -0.472 . . . . 73.340000000000003 111.12 179.796 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 56.8 mt-10 -72.64 -52.03 17.06 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.234 -0.439 . . . . 73.420000000000002 110.89 -179.917 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 30.4 m-85 -55.96 -39.6 71.99 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.151 -0.477 . . . . 74.319999999999993 110.861 -179.913 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.14 -31.35 65.25 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.109 -0.496 . . . . 73.299999999999997 110.883 -179.985 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 24.4 tt0 -72.27 -30.71 65.11 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.231 -0.44 . . . . 63.32 110.879 179.966 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -72.77 -35.04 67.35 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.162 -0.472 . . . . 65.230000000000004 111.115 179.92 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 91.5 t80 -75.63 -51.99 11.58 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.213 -0.449 . . . . 73.319999999999993 110.87 -179.874 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 14.8 t -52.03 -31.79 31.42 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.158 -0.474 . . . . 75.450000000000003 110.845 -179.79 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 15.9 tp -64.05 -47.11 81.46 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.071 -0.513 . . . . 73.010000000000005 110.911 -179.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 17.2 m-85 -69.79 -24.82 63.55 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.183 -0.462 . . . . 73.400000000000006 110.848 179.972 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 21.2 t0 -86.59 98.58 11.17 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.184 -0.462 . . . . 71.040000000000006 110.812 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 5.0 mptp? -71.23 -55.51 7.95 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.166 -0.47 . . . . 72.0 110.85 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 23.1 p-10 -71.12 -10.25 59.43 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.249 -0.432 . . . . 71.510000000000005 110.833 179.892 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 51.49 40.6 47.21 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.746 -0.74 . . . . 61.539999999999999 112.522 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 21.1 p-10 -88.31 -15.7 35.04 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.878 0.37 . . . . 74.319999999999993 110.909 -179.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 104.64 -11.69 50.17 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.72 -0.752 . . . . 73.230000000000004 112.518 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 5.0 p -129.05 130.67 46.86 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.739 0.305 . . . . 71.519999999999996 111.182 -179.896 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 24.8 mt -96.83 128.64 47.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.244 -0.434 . . . . 74.510000000000005 111.149 179.933 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 32.2 p -108.31 -177.5 3.34 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.159 -0.473 . . . . 74.129999999999995 111.187 179.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 39.2 p -64.6 -37.32 87.15 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.259 -0.428 . . . . 73.349999999999994 111.141 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 6.0 mmmm -71.99 -49.92 33.12 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.176 -0.466 . . . . 72.150000000000006 110.894 179.891 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 68.8 mt-10 -60.47 -36.61 78.67 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.212 -0.449 . . . . 75.439999999999998 110.879 179.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.2 tt -74.28 -55.63 5.81 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.131 -0.486 . . . . 75.340000000000003 110.931 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -52.08 -28.03 24.4 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.76 -0.734 . . . . 53.5 112.479 179.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 95.8 m -65.76 -54.51 26.14 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.767 0.318 . . . . 71.310000000000002 111.146 -179.889 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 42.7 t -55.98 -50.22 70.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.275 -0.421 . . . . 71.549999999999997 111.107 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -51.99 -38.06 55.37 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.177 -0.465 . . . . 64.120000000000005 110.853 179.915 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 32.7 ttm-85 -53.5 -52.89 58.12 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.277 -0.42 . . . . 74.439999999999998 110.872 -179.903 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 3.1 t -64.76 -26.56 68.41 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.199 -0.455 . . . . 64.239999999999995 110.864 -179.826 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 61.9 mt -79.45 -18.6 51.78 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.152 -0.477 . . . . 72.030000000000001 110.958 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 101.45 28.24 6.83 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.746 -0.74 . . . . 72.239999999999995 112.458 179.88 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 48.4 mm-40 -125.09 129.88 51.12 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.819 0.342 . . . . 62.439999999999998 110.908 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 39.2 t30 -109.86 80.02 1.61 Allowed Pre-proline 0 C--N 1.33 -0.28 0 CA-C-O 121.602 0.715 . . . . 72.319999999999993 110.896 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.7 147.94 64.37 Favored 'Trans proline' 0 C--O 1.231 0.174 0 C-N-CA 122.724 2.283 . . . . 75.0 112.346 179.913 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 21.3 p -96.01 162.56 13.5 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.209 -0.45 . . . . 72.540000000000006 111.189 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 20.7 tt0 -55.28 -44.39 75.61 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.26 -0.427 . . . . 74.430000000000007 110.846 -179.951 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.25 -31.73 64.28 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.186 -0.461 . . . . 75.549999999999997 111.094 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 78.4 tt0 -66.46 -49.29 67.16 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.246 -0.434 . . . . 75.319999999999993 110.92 -179.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 14.8 mt -55.15 -51.68 65.7 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.158 -0.474 . . . . 75.439999999999998 110.95 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 15.9 tp60 -55.01 -28.93 55.84 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.196 -0.456 . . . . 65.439999999999998 110.933 179.92 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -72.89 -40.05 65.9 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.182 -0.463 . . . . 73.409999999999997 110.825 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 38.2 mtp -76.36 -25.26 54.46 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.206 -0.452 . . . . 73.030000000000001 110.868 -179.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 80.3 mt -79.67 -40.64 21.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.259 -0.428 . . . . 74.230000000000004 111.14 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 49.2 m-20 -60.16 -48.8 80.21 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.178 -0.464 . . . . 74.319999999999993 110.905 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 18.0 pt-20 -55.7 -27.07 48.36 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.121 -0.49 . . . . 72.299999999999997 110.911 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 32.4 m -108.34 11.71 8.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.151 -0.477 . . . . 74.140000000000001 111.166 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 26.9 t0 -90.03 98.13 11.59 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.149 -0.478 . . . . 61.119999999999997 110.863 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.28 -46.25 9.37 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.206 -0.452 . . . . 63.329999999999998 111.13 179.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 10.2 p-10 -81.66 -0.19 41.49 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.196 -0.456 . . . . 75.019999999999996 110.863 179.96 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 53.65 56.5 19.93 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.718 -0.753 . . . . 61.100000000000001 112.508 -179.928 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 49.6 p-10 -114.51 -15.82 11.98 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.845 0.355 . . . . 73.430000000000007 110.861 -179.857 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 91.93 17.41 47.9 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.755 -0.736 . . . . 72.340000000000003 112.477 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 20.4 p -145.54 168.37 20.76 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.793 0.33 . . . . 73.430000000000007 111.11 -179.876 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 16.9 mt -106.72 109.49 28.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.163 -0.471 . . . . 73.319999999999993 111.133 179.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -76.9 -172.97 2.5 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.167 -0.469 . . . . 72.329999999999998 110.852 179.864 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.522 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 2.5 t80 -65.58 -58.43 11.77 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-O 121.667 0.746 . . . . 73.150000000000006 110.92 -179.936 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . 0.522 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 54.2 Cg_endo -69.75 -24.98 29.11 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.658 2.239 . . . . 75.349999999999994 112.365 179.949 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 22.7 mt-10 -63.66 -40.67 97.41 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.237 -0.438 . . . . 75.230000000000004 110.914 -179.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 34.3 t80 -74.02 -36.28 64.45 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.161 -0.472 . . . . 64.310000000000002 110.883 -179.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 50.1 tp -70.64 -53.9 14.03 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.171 -0.468 . . . . 75.349999999999994 110.949 179.981 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 13.1 t -55.64 -26.55 45.01 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.178 -0.465 . . . . 73.549999999999997 111.126 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 9.1 tmm? -62.83 -39.61 94.84 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.197 -0.456 . . . . 74.25 110.892 179.913 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -79.76 -40.02 29.7 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.22 -0.445 . . . . 74.430000000000007 110.938 179.918 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.287 0 CA-C-N 116.184 -0.462 . . . . 74.239999999999995 111.085 179.9 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 3.1 mp . . . . . 0 C--O 1.231 0.094 0 CA-C-O 120.861 0.362 . . . . 71.219999999999999 111.148 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 41.8 ttm-85 -54.69 -28.15 45.58 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.151 -0.477 . . . . 74.409999999999997 110.885 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 7.9 tm-20 -74.94 -58.52 3.23 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.177 -0.465 . . . . 71.400000000000006 110.866 -179.948 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -58.83 -43.31 90.63 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.177 -0.465 . . . . 74.549999999999997 111.129 179.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 4.1 t80 -52.01 -48.11 64.63 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.166 -0.47 . . . . 64.540000000000006 110.925 -179.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.22 -26.19 64.68 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.13 -0.486 . . . . 75.409999999999997 110.905 -179.95 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 93.0 t -77.36 -27.31 15.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.16 -0.473 . . . . 74.540000000000006 111.133 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 18.2 m-85 -94.77 -28.48 15.25 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.174 -0.466 . . . . 75.540000000000006 110.872 -179.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 34.6 t0 -66.9 95.86 0.39 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.12 -0.491 . . . . 74.519999999999996 110.888 179.981 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 71.1 mmtt -78.73 -52.26 8.63 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.201 -0.454 . . . . 72.120000000000005 110.899 179.997 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 10.2 p30 -72.32 -9.2 58.18 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.193 -0.458 . . . . 74.299999999999997 110.838 179.886 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 59.19 26.22 61.07 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.733 -0.746 . . . . 72.200000000000003 112.518 -179.923 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 35.7 p-10 -81.75 -16.16 51.99 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.91 0.386 . . . . 74.340000000000003 110.895 -179.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 87.05 18.71 57.34 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.742 -0.742 . . . . 70.400000000000006 112.506 -179.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 19.7 m-85 -141.96 146.55 35.76 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.834 0.349 . . . . 74.209999999999994 110.948 -179.791 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 62.1 mt -112.89 127.47 70.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.108 -0.496 . . . . 74.219999999999999 111.178 179.87 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 96.3 p -112.75 -172.59 2.08 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.163 -0.471 . . . . 74.530000000000001 110.835 -179.876 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -65.4 -34.14 77.61 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.129 -0.487 . . . . 73.329999999999998 111.095 179.914 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -70.4 -49.89 44.27 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.213 -0.449 . . . . 72.040000000000006 111.064 179.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 21.5 mt-10 -62.24 -50.21 72.67 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.243 -0.435 . . . . 73.120000000000005 110.853 -179.875 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 12.0 tp -53.6 -52.46 59.73 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.151 -0.477 . . . . 75.200000000000003 110.946 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 31.9 ttp180 -57.34 -42.29 81.69 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.158 -0.474 . . . . 73.219999999999999 110.855 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 50.3 t60 -60.34 -34.42 73.81 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.249 -0.432 . . . . 62.32 110.903 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 95.8 t -71.53 -52.47 25.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.188 -0.46 . . . . 74.310000000000002 111.087 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 5.6 tpp -62.69 -42.03 99.42 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.174 -0.467 . . . . 74.430000000000007 110.882 179.929 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 12.8 p -53.84 -36.62 62.77 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.255 -0.429 . . . . 73.310000000000002 111.138 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 87.9 m-20 -61.13 -30.24 70.25 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.248 -0.433 . . . . 73.310000000000002 110.893 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 23.5 mt -70.75 -23.38 62.42 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.168 -0.469 . . . . 72.439999999999998 110.914 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 101.02 32.98 5.12 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.77 -0.729 . . . . 63.310000000000002 112.509 179.901 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 34.9 tp10 -111.65 111.02 21.72 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.934 0.397 . . . . 71.409999999999997 110.922 -179.905 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 5.8 ptpp? -60.67 127.79 33.41 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.116 -0.493 . . . . 71.420000000000002 110.845 -179.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 30.5 mt -146.75 162.5 38.42 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.235 -0.438 . . . . 74.299999999999997 110.928 179.895 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 33.1 p -118.68 159.87 22.87 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.167 -0.47 . . . . 74.540000000000006 111.177 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -52.24 -39.58 60.49 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.217 -0.447 . . . . 71.340000000000003 110.857 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -72.48 -33.37 66.94 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.187 -0.46 . . . . 74.510000000000005 110.877 -179.893 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 65.4 tt0 -66.34 -39.21 89.05 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.15 -0.477 . . . . 75.219999999999999 110.888 -179.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 89.4 t -62.62 -34.24 64.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.158 -0.474 . . . . 73.310000000000002 111.133 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -51.97 -45.34 64.4 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.205 -0.452 . . . . 70.040000000000006 110.854 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 17.9 tp10 -56.62 -29.34 62.08 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.21 -0.45 . . . . 74.25 110.893 -179.915 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 8.7 mtp -74.46 -56.98 4.24 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.178 -0.464 . . . . 75.400000000000006 110.923 179.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 34.7 mm -54.05 -35.57 29.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.23 -0.441 . . . . 75.109999999999999 111.097 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 16.3 tpt180 -65.85 -31.75 72.88 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.203 -0.453 . . . . 73.400000000000006 110.869 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -71.33 -48.82 48.0 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.196 -0.456 . . . . 74.040000000000006 110.903 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -71.75 -34.2 69.31 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.165 -0.47 . . . . 63.25 111.089 179.97 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 49.8 t0 -68.27 86.79 0.28 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.228 -0.442 . . . . 75.439999999999998 110.887 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 56.5 mt -79.94 -46.0 22.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.204 -0.453 . . . . 73.430000000000007 111.124 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 21.7 p30 -72.7 -8.73 56.8 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.17 -0.468 . . . . 63.509999999999998 110.906 179.822 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 62.84 43.38 99.02 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.725 -0.75 . . . . 63.509999999999998 112.499 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 34.5 p-10 -88.69 -16.01 33.41 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.818 0.342 . . . . 75.340000000000003 110.841 -179.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 103.87 2.45 45.96 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.759 -0.734 . . . . 72.209999999999994 112.476 -179.928 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 4.5 tt0 -149.2 172.26 15.13 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.82 0.343 . . . . 74.209999999999994 110.941 -179.913 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 136' ' ' VAL . . . . . . . . . . . . . 94.4 t -108.21 111.82 37.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.204 -0.453 . . . . 75.129999999999995 111.082 179.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 15.5 p30 -91.85 179.63 5.56 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.155 -0.475 . . . . 74.109999999999999 110.917 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 36.1 t80 -63.97 -47.65 79.57 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.194 -0.457 . . . . 75.120000000000005 110.927 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 14.3 tt0 -52.04 -39.86 60.21 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.139 -0.482 . . . . 62.240000000000002 110.867 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -78.49 -42.46 29.62 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.221 -0.445 . . . . 64.209999999999994 110.898 -179.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 24.4 t80 -58.93 -36.7 75.2 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.15 -0.477 . . . . 74.409999999999997 110.859 -179.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 94.0 t -66.66 -44.85 89.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.184 -0.462 . . . . 75.310000000000002 111.119 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 31.1 tt0 -66.54 -42.94 86.41 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.207 -0.451 . . . . 75.319999999999993 110.91 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 33.6 tpp -65.11 -26.75 68.34 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.216 -0.447 . . . . 74.129999999999995 110.868 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -84.37 -28.16 27.17 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.232 -0.44 . . . . 72.310000000000002 110.832 179.973 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 1.6 m . . . . . 0 C--N 1.33 -0.276 0 CA-C-N 116.275 -0.42 . . . . 72.109999999999999 111.092 -179.886 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' M' M ' 15' ' ' LYS . . . . . . . . . . . . . 11.3 mttm . . . . . 0 N--CA 1.457 -0.08 0 CA-C-O 120.744 0.307 . . . . 75.519999999999996 110.871 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' M' M ' 16' ' ' TRP . . . . . . . . . . . . . 5.6 m95 -52.27 -42.97 64.15 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.231 -0.441 . . . . 75.319999999999993 110.909 179.921 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' M' M ' 17' ' ' GLU . . . . . . . . . . . . . 48.3 tt0 -58.37 -28.08 64.8 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.224 -0.443 . . . . 74.310000000000002 110.902 -179.942 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' M' M ' 18' ' ' LYS . . . . . . . . . . . . . 14.2 ttmm -68.36 -25.85 65.29 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.146 -0.479 . . . . 73.230000000000004 110.892 179.948 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' M' M ' 19' ' ' ILE . . . . . . . . . . . . . 33.5 mt -86.46 -13.2 10.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.23 -0.441 . . . . 73.530000000000001 111.131 179.865 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' M' M ' 20' ' ' ARG . . . . . . . . . . . . . 39.7 ttp180 . . . . . 0 C--N 1.328 -0.335 0 CA-C-N 116.178 -0.465 . . . . 71.040000000000006 110.897 179.926 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' M' M ' 30' ' ' LYS . . . . . . . . . . . . . 17.4 tttm . . . . . 0 C--O 1.232 0.137 0 CA-C-O 120.762 0.315 . . . . 73.540000000000006 110.862 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' M' M ' 31' ' ' LEU . . . . . . . . . . . . . 10.1 tp -144.94 -52.16 0.28 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.256 -0.429 . . . . 75.230000000000004 110.934 179.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' M' M ' 32' ' ' LYS . . . . . . . . . . . . . 3.2 ptmm? -49.53 -36.18 22.63 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.188 -0.46 . . . . 75.519999999999996 110.9 179.824 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' M' M ' 33' ' ' HIS . . . . . . . . . . . . . 12.7 t-160 -49.74 -42.61 46.66 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.201 -0.454 . . . . 73.400000000000006 110.861 179.898 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' M' M ' 34' ' ' ILE . . . . . . . . . . . . . 55.1 mt -50.69 -38.69 17.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.201 -0.454 . . . . 74.5 111.145 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' M' M ' 35' ' ' VAL . . . . . . . . . . . . . 39.9 t -49.6 -39.54 14.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.139 -0.482 . . . . 75.120000000000005 111.166 179.859 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' M' M ' 36' ' ' TRP . . . . . . . . . . . . . 21.9 m0 -58.94 -39.29 81.18 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.196 -0.456 . . . . 72.099999999999994 110.926 179.966 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' M' M ' 37' ' ' ALA . . . . . . . . . . . . . . . -63.82 -18.64 64.33 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.226 -0.443 . . . . 72.439999999999998 111.091 179.88 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' M' M ' 38' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -71.88 -17.96 62.08 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.193 -0.458 . . . . 75.420000000000002 110.843 -179.787 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' M' M ' 39' ' ' ARG . . . . . . . . . . . . . 60.1 mtt180 -56.48 -25.83 52.32 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.201 -0.454 . . . . 74.109999999999999 110.894 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' M' M ' 40' ' ' GLU . . . . . . . . . . . . . 22.7 tt0 -87.43 -47.99 8.33 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.205 -0.452 . . . . 75.200000000000003 110.905 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' M' M ' 41' ' ' LEU . . . . . . . . . . . . . 11.7 mt . . . . . 0 C--N 1.328 -0.364 0 CA-C-N 116.179 -0.464 . . . . 73.019999999999996 110.957 -179.993 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 7.0 tp60 . . . . . 0 C--O 1.232 0.135 0 CA-C-O 120.804 0.335 . . . . 74.030000000000001 110.898 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 78.3 mt -69.35 -40.61 80.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.195 -0.457 . . . . 72.450000000000003 111.147 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -53.21 -31.4 42.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.133 -0.485 . . . . 63.539999999999999 111.105 179.787 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -74.12 -39.36 63.4 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.225 -0.443 . . . . 73.120000000000005 110.913 -179.924 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 24.7 m-85 -72.25 -45.89 58.28 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.189 -0.459 . . . . 74.230000000000004 110.918 -179.954 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 24.2 ttpp -67.45 -26.75 66.55 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.148 -0.478 . . . . 72.129999999999995 110.88 179.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -67.02 -38.64 86.29 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.256 -0.429 . . . . 75.120000000000005 110.866 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -64.01 -34.06 77.15 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.122 -0.49 . . . . 73.030000000000001 111.121 179.887 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 51.7 t80 -57.3 -53.87 53.18 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.224 -0.444 . . . . 65.200000000000003 110.832 -179.895 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.7 t -52.6 -29.66 27.08 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.175 -0.466 . . . . 54.530000000000001 110.843 -179.785 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 15.6 tp -67.12 -48.17 68.9 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.141 -0.481 . . . . 71.439999999999998 110.91 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 44.5 m-85 -71.78 -25.34 61.98 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.227 -0.442 . . . . 75.319999999999993 110.886 179.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 8.1 t0 -82.54 98.56 9.02 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.139 -0.482 . . . . 73.129999999999995 110.903 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 21.7 ttmm -69.21 -53.46 19.84 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.206 -0.452 . . . . 72.030000000000001 110.888 179.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 9.7 p30 -76.78 -10.09 59.13 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.24 -0.436 . . . . 41.409999999999997 110.833 179.915 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 52.15 46.49 56.47 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.701 -0.761 . . . . 62.020000000000003 112.501 -179.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 38.4 p-10 -89.08 -12.47 41.11 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.845 0.355 . . . . 75.219999999999999 110.853 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 105.44 -11.69 47.18 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.72 -0.752 . . . . 64.319999999999993 112.477 -179.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 56.0 p -133.59 130.69 38.71 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.788 0.328 . . . . 75.129999999999995 111.125 -179.827 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 47.3 mt -84.45 125.7 40.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.193 -0.458 . . . . 75.439999999999998 111.123 179.908 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 28.3 p -107.81 171.09 7.59 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.158 -0.474 . . . . 73.109999999999999 111.109 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 16.3 p -54.21 -45.02 72.14 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.158 -0.474 . . . . 75.109999999999999 111.187 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 4.9 tmtm? -60.14 -37.3 79.67 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.177 -0.465 . . . . 74.040000000000006 110.911 179.91 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -74.0 -32.86 63.59 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.265 -0.425 . . . . 73.430000000000007 110.89 179.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -74.28 -39.98 62.59 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.169 -0.469 . . . . 73.420000000000002 110.892 -179.967 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -71.58 -38.03 61.78 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.735 -0.745 . . . . 71.129999999999995 112.537 179.87 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 96.1 m -62.79 -55.96 21.75 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.817 0.341 . . . . 72.420000000000002 111.185 -179.899 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 71.4 t -54.63 -51.79 47.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.208 -0.451 . . . . 74.409999999999997 111.13 179.875 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 26.4 mtp -52.08 -31.51 30.71 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.205 -0.452 . . . . 73.200000000000003 110.884 179.91 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 45.4 ttp180 -63.37 -43.92 96.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.245 -0.434 . . . . 74.530000000000001 110.865 -179.912 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.3 p -65.25 -34.22 77.85 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.163 -0.472 . . . . 75.439999999999998 110.85 -179.779 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 32.1 mt -72.11 -19.84 61.73 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.176 -0.465 . . . . 74.319999999999993 110.892 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 101.46 30.07 6.05 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.772 -0.728 . . . . 73.200000000000003 112.52 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 83.9 mm-40 -118.64 132.59 56.18 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.798 0.332 . . . . 75.310000000000002 110.928 -179.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 33.5 t-20 -109.88 76.63 0.98 Allowed Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.618 0.723 . . . . 64.430000000000007 110.864 -179.9 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.73 164.65 33.73 Favored 'Trans proline' 0 C--N 1.341 0.17 0 C-N-CA 122.69 2.26 . . . . 73.230000000000004 112.36 179.94 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 19.6 p -112.93 166.41 11.42 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.211 -0.45 . . . . 72.230000000000004 111.172 179.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -59.17 -42.26 90.4 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.229 -0.441 . . . . 75.150000000000006 110.891 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.23 -31.58 64.23 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.153 -0.476 . . . . 53.310000000000002 111.079 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -71.88 -52.1 19.01 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.212 -0.449 . . . . 62.200000000000003 110.893 -179.92 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 18.8 mt -56.09 -51.78 66.64 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.16 -0.473 . . . . 74.439999999999998 110.953 179.985 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 28.6 tp60 -52.85 -29.19 26.52 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.174 -0.466 . . . . 62.43 110.935 179.931 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -75.5 -43.4 49.32 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.213 -0.449 . . . . 72.239999999999995 110.892 179.915 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 68.2 mtp -58.31 -58.04 10.26 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.149 -0.478 . . . . 75.120000000000005 110.891 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 79.6 mt -55.89 -42.06 69.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.19 -0.459 . . . . 73.420000000000002 111.115 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 63.4 m-20 -60.51 -31.28 70.34 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.15 -0.477 . . . . 75.219999999999999 110.877 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -71.26 -23.29 61.95 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.196 -0.456 . . . . 75.010000000000005 110.912 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 2.9 m -114.0 10.87 8.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.15 -0.477 . . . . 64.430000000000007 111.135 179.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 23.2 t0 -90.16 97.67 11.32 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.156 -0.475 . . . . 72.340000000000003 110.868 179.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.29 -44.27 10.94 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.247 -0.433 . . . . 62.030000000000001 111.106 179.946 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 6.4 p-10 -83.09 -0.22 48.07 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.205 -0.452 . . . . 73.040000000000006 110.865 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 51.6 57.38 12.29 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.712 -0.756 . . . . 62.200000000000003 112.485 -179.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 53.1 p-10 -114.56 -15.72 11.97 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.853 0.359 . . . . 74.310000000000002 110.845 -179.848 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 89.28 17.81 54.62 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.771 -0.728 . . . . 72.230000000000004 112.459 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 28.5 p -150.15 158.67 44.4 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.74 0.305 . . . . 75.530000000000001 111.145 -179.868 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 7.6 mm -94.6 110.12 23.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.267 -0.424 . . . . 72.510000000000005 111.14 179.924 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -77.47 -172.79 2.65 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.151 -0.477 . . . . 75.349999999999994 110.837 179.9 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.524 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 2.5 t80 -64.59 -58.31 13.92 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.621 0.724 . . . . 73.319999999999993 110.852 -179.942 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . 0.524 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 54.2 Cg_endo -69.76 -29.9 23.13 Favored 'Trans proline' 0 N--CA 1.465 -0.159 0 C-N-CA 122.698 2.265 . . . . 63.409999999999997 112.372 -179.981 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 11.5 mt-10 -57.17 -41.63 79.63 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.177 -0.465 . . . . 73.450000000000003 110.865 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 5.7 t80 -72.77 -36.12 67.58 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.166 -0.47 . . . . 72.099999999999994 110.845 -179.898 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 19.2 tp -65.42 -53.76 38.33 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.139 -0.482 . . . . 74.519999999999996 110.91 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 9.4 t -55.24 -28.38 52.83 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.212 -0.449 . . . . 71.439999999999998 111.157 179.944 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 6.2 tmm? -68.12 -40.07 82.58 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.181 -0.463 . . . . 73.120000000000005 110.897 179.911 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -79.85 -33.57 40.06 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.194 -0.457 . . . . 71.409999999999997 110.861 179.967 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.296 0 CA-C-N 116.22 -0.446 . . . . 63.310000000000002 111.075 179.936 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 53.2 mt . . . . . 0 N--CA 1.457 -0.101 0 CA-C-O 120.83 0.347 . . . . 70.549999999999997 111.134 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 12.2 ttt180 -62.21 -28.33 69.61 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.146 -0.479 . . . . 73.109999999999999 110.858 179.977 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -70.21 -58.38 3.84 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.221 -0.445 . . . . 75.409999999999997 110.91 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -54.29 -45.39 72.5 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.095 -0.502 . . . . 75.200000000000003 111.107 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 6.7 t80 -52.06 -51.33 58.24 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.211 -0.449 . . . . 74.230000000000004 110.909 -179.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 13.2 ttt85 -61.68 -40.52 95.26 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.121 -0.49 . . . . 73.530000000000001 110.869 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 39.0 t -59.45 -51.15 76.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.214 -0.448 . . . . 75.209999999999994 111.137 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 11.8 m-85 -68.56 -29.04 67.51 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.159 -0.473 . . . . 74.299999999999997 110.838 -179.972 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 33.1 t0 -70.45 94.09 0.94 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.158 -0.473 . . . . 65.209999999999994 110.881 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 2.6 mptm? -78.67 -52.09 8.92 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.215 -0.448 . . . . 75.420000000000002 110.869 -179.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 47.6 p30 -72.5 -9.17 58.23 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.219 -0.446 . . . . 73.319999999999993 110.895 179.86 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 59.95 28.71 66.54 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.7 -0.762 . . . . 71.310000000000002 112.521 -179.924 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 45.3 p-10 -82.39 -16.25 49.77 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.882 0.372 . . . . 74.030000000000001 110.896 -179.882 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 88.56 18.66 54.49 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.717 -0.754 . . . . 42.310000000000002 112.452 179.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 13.4 m-85 -136.03 159.41 41.78 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.841 0.353 . . . . 75.420000000000002 110.949 -179.827 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 71.4 mt -122.04 120.84 62.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.119 -0.491 . . . . 74.530000000000001 111.159 179.87 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 4.9 p -114.9 175.0 5.69 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.189 -0.46 . . . . 74.310000000000002 110.864 -179.905 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -66.15 -25.17 66.84 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.119 -0.491 . . . . 73.010000000000005 111.064 179.927 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -71.07 -49.94 39.22 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.228 -0.442 . . . . 75.200000000000003 111.125 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -76.97 -48.05 19.11 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.228 -0.442 . . . . 75.329999999999998 110.899 -179.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 19.0 tp -53.14 -40.45 64.27 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.155 -0.475 . . . . 74.400000000000006 110.907 -179.957 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 41.6 ttp180 -56.49 -49.43 74.71 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.155 -0.475 . . . . 72.430000000000007 110.894 179.938 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 6.2 t60 -54.28 -36.46 63.68 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.171 -0.468 . . . . 73.230000000000004 110.818 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 85.7 t -63.53 -51.66 67.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.219 -0.446 . . . . 72.129999999999995 111.129 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 5.4 mmt -60.58 -26.02 66.64 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.239 -0.437 . . . . 75.439999999999998 110.866 179.931 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 1.6 m -66.77 -45.2 79.28 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.206 -0.452 . . . . 65.349999999999994 111.164 -179.956 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 5.6 t30 -55.29 -30.62 60.52 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.245 -0.434 . . . . 63.240000000000002 110.868 179.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 7.8 mt -75.42 -25.41 57.5 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.227 -0.442 . . . . 71.120000000000005 110.945 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 101.02 32.98 5.12 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.706 -0.759 . . . . 71.340000000000003 112.487 179.866 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -124.25 109.96 14.04 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.873 0.368 . . . . 75.25 110.865 -179.8 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 19.2 mmtm -74.76 128.62 36.0 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.143 -0.48 . . . . 71.409999999999997 110.904 179.957 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 10.4 mt -133.17 126.69 32.2 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.235 -0.438 . . . . 75.209999999999994 110.904 179.954 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 68.6 p -79.3 -175.06 4.48 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.212 -0.449 . . . . 70.540000000000006 111.109 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -59.84 -40.26 87.92 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.18 -0.464 . . . . 71.510000000000005 110.865 179.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -75.71 -33.39 60.32 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.253 -0.431 . . . . 73.420000000000002 110.86 -179.912 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 46.8 tt0 -71.98 -38.17 69.74 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.163 -0.471 . . . . 71.299999999999997 110.894 -179.931 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 92.8 t -74.31 -30.55 26.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.181 -0.463 . . . . 75.239999999999995 111.109 179.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -78.54 -28.29 46.07 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.2 -0.455 . . . . 74.099999999999994 110.839 179.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 23.0 tp10 -55.52 -49.99 71.16 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.224 -0.444 . . . . 73.150000000000006 110.904 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 13.6 ptm -66.42 -44.12 83.83 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.156 -0.474 . . . . 73.019999999999996 110.922 179.953 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 29.3 mm -53.87 -35.38 27.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.175 -0.466 . . . . 75.340000000000003 111.138 179.945 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 14.1 ttt85 -67.18 -31.7 72.28 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.187 -0.46 . . . . 75.209999999999994 110.867 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 13.1 tp10 -69.14 -45.16 70.8 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.18 -0.464 . . . . 72.329999999999998 110.923 -179.975 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -77.12 -33.18 56.88 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.154 -0.476 . . . . 72.409999999999997 111.091 179.918 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 47.6 t0 -68.9 85.99 0.34 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.258 -0.428 . . . . 72.230000000000004 110.836 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 57.0 mt -79.69 -45.55 23.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.218 -0.446 . . . . 72.040000000000006 111.135 179.977 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 24.5 p30 -72.87 -8.63 56.46 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.175 -0.466 . . . . 61.340000000000003 110.854 179.849 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 62.72 41.91 99.77 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.793 -0.718 . . . . 52.509999999999998 112.463 -179.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 13.3 p-10 -87.6 -15.84 36.21 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.843 0.354 . . . . 75.230000000000004 110.851 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 102.41 4.23 49.99 Favored Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.687 -0.768 . . . . 72.439999999999998 112.482 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -149.19 172.18 15.26 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.861 0.362 . . . . 75.209999999999994 110.909 -179.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 136' ' ' VAL . . . . . . . . . . . . . 99.6 t -110.83 113.75 45.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.185 -0.461 . . . . 71.540000000000006 111.128 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 14.0 p30 -91.02 167.87 12.07 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.132 -0.486 . . . . 74.310000000000002 110.885 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 88.7 t80 -52.08 -47.17 65.32 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.171 -0.468 . . . . 72.030000000000001 110.92 -179.909 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 26.1 tp10 -52.53 -51.78 57.95 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.104 -0.498 . . . . 64.200000000000003 110.844 -179.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 51.7 mt-10 -66.16 -39.88 90.11 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.179 -0.464 . . . . 73.439999999999998 110.899 -179.919 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 75.7 t80 -59.45 -49.16 78.86 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.181 -0.463 . . . . 75.430000000000007 110.879 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 91.8 t -56.58 -40.08 66.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.164 -0.471 . . . . 75.430000000000007 111.162 179.94 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 6.9 tp-100 -70.01 -28.34 65.42 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.179 -0.464 . . . . 75.25 110.895 179.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 9.5 tpt -74.6 -54.03 8.24 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.229 -0.441 . . . . 72.340000000000003 110.89 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 7.7 ttm -66.88 -27.17 67.29 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.218 -0.446 . . . . 73.140000000000001 110.875 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 2.3 m . . . . . 0 C--N 1.329 -0.288 0 CA-C-N 116.233 -0.439 . . . . 75.030000000000001 111.139 -179.888 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' M' M ' 15' ' ' LYS . . . . . . . . . . . . . 24.1 mttp . . . . . 0 C--O 1.231 0.103 0 CA-C-O 120.736 0.303 . . . . 74.129999999999995 110.852 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' M' M ' 16' ' ' TRP . . . . . . . . . . . . . 46.2 m95 -52.77 -40.55 63.26 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.217 -0.447 . . . . 74.109999999999999 110.904 179.972 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' M' M ' 17' ' ' GLU . . . . . . . . . . . . . 28.5 tt0 -55.43 -26.28 41.0 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.234 -0.439 . . . . 71.140000000000001 110.87 -179.948 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' M' M ' 18' ' ' LYS . . . . . . . . . . . . . 16.2 ttpp -77.65 -28.02 51.16 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.145 -0.48 . . . . 75.409999999999997 110.841 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' M' M ' 19' ' ' ILE . . . . . . . . . . . . . 60.2 mt -78.3 -29.38 15.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.22 -0.446 . . . . 74.439999999999998 111.164 179.894 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' M' M ' 20' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.288 0 CA-C-N 116.157 -0.474 . . . . 72.540000000000006 110.906 179.906 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' M' M ' 30' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.232 0.143 0 CA-C-O 120.825 0.345 . . . . 74.420000000000002 110.905 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' M' M ' 31' ' ' LEU . . . . . . . . . . . . . 25.9 tp -141.72 -55.44 0.46 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.258 -0.428 . . . . 72.439999999999998 110.897 179.938 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' M' M ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.68 -45.38 48.71 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.183 -0.462 . . . . 65.340000000000003 110.909 179.851 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' M' M ' 33' ' ' HIS . . . . . . . . . . . . . 19.0 t-80 -50.36 -36.91 34.42 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.166 -0.47 . . . . 74.239999999999995 110.864 179.897 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' M' M ' 34' ' ' ILE . . . . . . . . . . . . . 49.7 mm -49.74 -40.83 16.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.191 -0.459 . . . . 74.129999999999995 111.171 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' M' M ' 35' ' ' VAL . . . . . . . . . . . . . 65.9 t -49.26 -40.63 13.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.15 -0.477 . . . . 74.030000000000001 111.176 179.772 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' M' M ' 36' ' ' TRP . . . . . . . . . . . . . 28.8 m0 -59.31 -38.88 81.35 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.14 -0.482 . . . . 75.299999999999997 110.965 179.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' M' M ' 37' ' ' ALA . . . . . . . . . . . . . . . -63.9 -18.61 64.37 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.167 -0.47 . . . . 73.0 111.108 179.876 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' M' M ' 38' ' ' SER . . . . . . . . . . . . . 2.5 m -70.61 -17.97 62.89 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.234 -0.439 . . . . 61.240000000000002 110.86 -179.82 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' M' M ' 39' ' ' ARG . . . . . . . . . . . . . 16.2 mmm180 -60.13 -26.8 66.54 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.176 -0.466 . . . . 75.430000000000007 110.878 -179.932 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' M' M ' 40' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -74.63 -47.76 30.28 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.205 -0.452 . . . . 64.400000000000006 110.908 -179.946 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' M' M ' 41' ' ' LEU . . . . . . . . . . . . . 15.3 mt . . . . . 0 C--N 1.328 -0.345 0 CA-C-N 116.17 -0.468 . . . . 72.219999999999999 110.92 -179.991 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 7.5 tp60 . . . . . 0 C--O 1.231 0.086 0 CA-C-O 120.732 0.301 . . . . 63.509999999999998 110.893 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 41.4 mt -68.58 -37.09 77.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.209 -0.451 . . . . 75.340000000000003 111.12 179.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -52.0 -33.16 37.03 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.15 -0.477 . . . . 75.319999999999993 111.139 179.815 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 16.2 mm-40 -74.9 -51.87 12.73 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.203 -0.453 . . . . 75.409999999999997 110.878 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 64.5 m-85 -58.18 -46.03 86.47 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.191 -0.459 . . . . 73.519999999999996 110.888 -179.925 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 19.5 ttmm -54.18 -30.45 49.58 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.159 -0.473 . . . . 75.129999999999995 110.886 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -70.84 -30.69 67.18 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.223 -0.444 . . . . 65.209999999999994 110.87 179.946 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -67.02 -48.16 69.22 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.16 -0.473 . . . . 73.140000000000001 111.083 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 79.2 t80 -56.09 -54.28 46.97 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.2 -0.454 . . . . 63.439999999999998 110.891 -179.932 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 20.6 t -58.99 -26.49 64.54 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.174 -0.466 . . . . 53.340000000000003 110.88 -179.8 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 1.2 tt -68.75 -37.33 79.31 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.117 -0.492 . . . . 73.140000000000001 110.909 -179.999 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 22.3 m-85 -81.33 -39.09 25.65 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.19 -0.459 . . . . 75.430000000000007 110.88 179.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 26.5 t0 -62.97 98.56 0.13 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.164 -0.471 . . . . 73.549999999999997 110.906 179.931 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.14 -56.05 6.24 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.223 -0.444 . . . . 75.129999999999995 110.919 179.978 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 2.3 p-10 -70.86 -10.45 59.62 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.212 -0.449 . . . . 70.230000000000004 110.859 179.901 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 50.86 66.43 2.47 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.708 -0.758 . . . . 74.019999999999996 112.496 -179.93 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 35.3 p-10 -114.47 -15.71 12.02 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.828 0.347 . . . . 72.310000000000002 110.848 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 100.53 10.28 44.62 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.755 -0.736 . . . . 75.230000000000004 112.457 -179.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 51.0 p -151.29 130.7 12.91 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.771 0.319 . . . . 62.109999999999999 111.135 -179.865 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 22.5 mt -91.08 121.78 41.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.218 -0.446 . . . . 74.040000000000006 111.071 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 30.0 p -107.77 172.82 6.62 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.153 -0.476 . . . . 63.210000000000001 111.128 179.932 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 71.4 p -61.41 -27.55 68.61 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.201 -0.454 . . . . 75.0 111.164 -179.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 19.5 mmmt -75.7 -35.19 60.36 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.223 -0.444 . . . . 64.430000000000007 110.93 179.909 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 -76.06 -32.66 59.4 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.19 -0.459 . . . . 74.319999999999993 110.898 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -67.15 -39.79 86.6 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.123 -0.49 . . . . 65.200000000000003 110.93 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -67.92 -35.51 84.68 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.71 -0.757 . . . . 75.140000000000001 112.528 179.849 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 74.6 m -62.81 -55.47 26.11 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.808 0.337 . . . . 62.229999999999997 111.158 -179.876 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 92.4 t -65.28 -53.32 41.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.248 -0.433 . . . . 75.349999999999994 111.109 179.901 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -51.9 -31.5 28.66 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.179 -0.464 . . . . 75.519999999999996 110.884 179.947 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 48.6 ttt180 -65.95 -47.09 75.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.221 -0.445 . . . . 74.040000000000006 110.897 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.3 p -63.66 -33.67 76.15 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.159 -0.473 . . . . 65.040000000000006 110.888 -179.81 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 57.7 mt -68.09 -22.11 64.93 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.1 -0.5 . . . . 73.019999999999996 110.91 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 101.43 31.37 5.56 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.729 -0.748 . . . . 74.340000000000003 112.505 179.915 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 13.9 mt-30 -128.29 118.62 23.57 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.793 0.33 . . . . 64.010000000000005 110.911 -179.896 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 1.2 t30 -109.86 76.92 1.0 Allowed Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.65 0.738 . . . . 71.319999999999993 110.86 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.85 168.08 22.71 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.695 2.263 . . . . 71.5 112.297 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 30.9 p -90.78 161.69 15.18 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.234 -0.439 . . . . 71.319999999999993 111.081 -179.91 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 25.2 tt0 -51.95 -43.7 63.62 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.157 -0.474 . . . . 72.329999999999998 110.883 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.14 -31.49 64.3 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.142 -0.481 . . . . 72.340000000000003 111.063 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 53.7 tt0 -65.96 -48.25 71.93 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.238 -0.437 . . . . 73.400000000000006 110.917 -179.938 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 46.4 mt -55.34 -35.35 65.09 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.152 -0.476 . . . . 75.200000000000003 110.932 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 43.8 tp60 -70.92 -28.96 64.9 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.184 -0.462 . . . . 74.310000000000002 110.873 179.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 29.3 t0 -68.73 -46.61 68.47 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.216 -0.447 . . . . 65.150000000000006 110.869 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 10.7 mtp -60.18 -53.0 62.9 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.184 -0.462 . . . . 75.430000000000007 110.877 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 73.3 mt -60.46 -41.25 86.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.226 -0.443 . . . . 63.409999999999997 111.159 179.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 70.7 m-20 -67.89 -32.73 73.42 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.155 -0.475 . . . . 74.329999999999998 110.894 179.934 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 18.4 mm-40 -61.01 -23.28 65.29 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.182 -0.463 . . . . 71.420000000000002 110.887 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 3.8 m -112.52 -14.89 10.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.162 -0.472 . . . . 52.439999999999998 111.109 179.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 33.0 t0 -66.79 97.07 0.44 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.172 -0.467 . . . . 74.099999999999994 110.85 179.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.46 -32.71 18.12 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.159 -0.473 . . . . 73.030000000000001 111.074 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -91.69 -0.43 57.56 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.234 -0.439 . . . . 72.25 110.851 179.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 51.46 62.21 5.68 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.699 -0.762 . . . . 41.149999999999999 112.509 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 50.7 p-10 -114.58 -15.75 11.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.864 0.364 . . . . 73.5 110.877 -179.873 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 89.11 15.83 58.54 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.751 -0.738 . . . . 63.100000000000001 112.49 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 30.7 p -152.17 161.54 42.47 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.758 0.313 . . . . 74.540000000000006 111.143 -179.865 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 8.6 mm -99.26 114.8 38.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.194 -0.457 . . . . 72.519999999999996 111.133 179.921 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -81.79 -173.01 4.2 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.153 -0.476 . . . . 63.329999999999998 110.88 179.846 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.521 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 2.5 t80 -66.55 -58.3 10.38 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.669 0.747 . . . . 74.409999999999997 110.857 -179.911 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . 0.521 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 53.1 Cg_endo -69.78 -29.41 23.8 Favored 'Trans proline' 0 C--N 1.342 0.202 0 C-N-CA 122.677 2.251 . . . . 74.510000000000005 112.332 -179.947 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -61.48 -40.26 93.91 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.217 -0.447 . . . . 72.040000000000006 110.896 -179.976 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 14.7 t80 -74.52 -35.56 63.16 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.149 -0.478 . . . . 72.420000000000002 110.886 -179.955 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 19.0 tp -69.98 -54.16 14.49 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.121 -0.49 . . . . 73.510000000000005 110.921 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 14.8 t -51.93 -29.77 21.68 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.146 -0.479 . . . . 75.310000000000002 111.109 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 3.6 tmm? -61.86 -43.4 98.92 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.247 -0.433 . . . . 74.150000000000006 110.844 179.937 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 3.8 mmt -79.85 -29.4 40.06 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.249 -0.432 . . . . 71.310000000000002 110.846 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.273 0 CA-C-N 116.233 -0.44 . . . . 75.140000000000001 111.146 179.909 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 47.7 mt . . . . . 0 C--O 1.232 0.141 0 CA-C-O 120.804 0.335 . . . . 75.310000000000002 111.147 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 2.7 ttt180 -61.13 -32.42 72.12 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.167 -0.469 . . . . 75.340000000000003 110.865 179.942 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -76.68 -57.18 4.0 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.224 -0.444 . . . . 65.540000000000006 110.9 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -53.49 -51.03 64.08 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.177 -0.465 . . . . 71.430000000000007 111.081 179.924 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -54.2 -41.79 69.0 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.191 -0.458 . . . . 75.430000000000007 110.878 -179.932 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 73.1 ttt180 -70.41 -27.32 64.19 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.161 -0.472 . . . . 71.129999999999995 110.9 -179.942 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 93.7 t -75.61 -28.26 19.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.178 -0.464 . . . . 62.299999999999997 111.141 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 8.8 m-85 -93.08 -35.64 13.11 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.144 -0.48 . . . . 75.219999999999999 110.898 -179.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 35.1 t0 -64.67 94.16 0.12 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.125 -0.489 . . . . 74.230000000000004 110.857 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 10.1 tppt? -78.64 -51.52 9.76 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.193 -0.458 . . . . 74.349999999999994 110.915 179.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 17.8 p30 -72.7 -9.14 58.28 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.218 -0.446 . . . . 74.299999999999997 110.834 179.919 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 59.76 28.32 65.45 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.713 -0.756 . . . . 63.409999999999997 112.528 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 43.8 p-10 -81.85 -16.18 51.64 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.887 0.375 . . . . 70.109999999999999 110.893 -179.87 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 91.03 18.64 46.05 Favored Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.717 -0.754 . . . . 73.540000000000006 112.5 179.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 12.5 m-85 -136.6 148.18 47.36 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.907 0.384 . . . . 75.319999999999993 110.933 -179.812 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 78.8 mt -113.78 121.33 65.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.139 -0.482 . . . . 74.010000000000005 111.114 179.921 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 17.8 p -116.2 175.25 5.63 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.145 -0.479 . . . . 74.510000000000005 110.859 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -66.33 -33.32 75.48 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.129 -0.487 . . . . 74.340000000000003 111.079 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -61.59 -49.93 74.64 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.251 -0.431 . . . . 73.420000000000002 111.076 179.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 23.7 mt-10 -76.91 -49.18 16.21 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.207 -0.452 . . . . 74.430000000000007 110.925 -179.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 18.9 tp -53.3 -34.49 57.55 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.114 -0.494 . . . . 72.5 110.931 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 57.4 ttp180 -59.8 -48.05 83.23 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.2 -0.455 . . . . 75.25 110.843 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 70.9 t60 -54.38 -34.39 61.12 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.203 -0.453 . . . . 63.240000000000002 110.831 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 42.3 t -65.5 -48.9 81.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.243 -0.435 . . . . 73.420000000000002 111.139 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 7.6 mmt -59.48 -45.06 92.75 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.163 -0.471 . . . . 72.409999999999997 110.866 179.922 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -57.56 -39.11 75.96 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.183 -0.462 . . . . 74.430000000000007 111.183 -179.942 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 10.6 t-20 -74.59 -26.55 59.99 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.168 -0.469 . . . . 72.319999999999993 110.9 179.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 12.3 mt -70.77 -25.97 63.14 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.238 -0.437 . . . . 73.049999999999997 110.903 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 101.01 33.02 5.11 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.724 -0.75 . . . . 74.140000000000001 112.452 179.862 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -124.05 113.43 18.38 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.948 0.404 . . . . 70.530000000000001 110.865 -179.863 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 9.1 pttm -70.32 118.68 13.44 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.131 -0.486 . . . . 75.120000000000005 110.913 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 24.5 mt -137.41 163.3 31.39 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.2 -0.455 . . . . 74.0 110.89 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 65.9 p -113.01 174.45 5.89 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.22 -0.445 . . . . 74.109999999999999 111.132 179.925 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -53.37 -48.11 68.88 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.223 -0.444 . . . . 75.239999999999995 110.875 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 49.9 tt0 -62.47 -38.57 90.35 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.23 -0.441 . . . . 72.120000000000005 110.886 -179.92 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -61.55 -46.77 88.52 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.143 -0.48 . . . . 74.150000000000006 110.897 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 62.1 t -57.07 -32.22 39.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.18 -0.464 . . . . 75.099999999999994 111.127 179.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 3.1 t70 -78.51 -28.49 46.29 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.192 -0.458 . . . . 61.329999999999998 110.88 179.919 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 34.5 tp10 -55.6 -50.0 71.28 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.203 -0.453 . . . . 74.25 110.88 -179.928 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 13.4 ptm -66.61 -44.36 82.29 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.16 -0.473 . . . . 73.230000000000004 110.878 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 28.9 mm -53.88 -35.47 27.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.189 -0.46 . . . . 65.120000000000005 111.099 179.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 18.3 ttt-85 -66.88 -31.58 72.28 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.197 -0.456 . . . . 73.439999999999998 110.868 179.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 6.9 tm-20 -70.36 -47.26 61.79 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.164 -0.471 . . . . 75.150000000000006 110.83 -179.896 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -74.23 -33.8 63.47 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.184 -0.462 . . . . 65.319999999999993 111.068 179.957 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 50.1 t0 -68.54 86.74 0.31 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.257 -0.429 . . . . 62.329999999999998 110.867 -179.999 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 57.7 mt -79.75 -45.61 23.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.182 -0.463 . . . . 75.219999999999999 111.116 -179.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 22.9 p30 -72.73 -8.69 56.62 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.201 -0.454 . . . . 74.319999999999993 110.851 179.864 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 62.31 41.57 99.74 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.769 -0.729 . . . . 72.0 112.517 -179.925 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 34.6 p-10 -86.85 -15.91 37.71 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.851 0.358 . . . . 73.239999999999995 110.848 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 101.93 3.72 51.78 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.76 -0.733 . . . . 62.43 112.47 -179.94 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 3.5 tt0 -149.23 172.22 15.21 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.83 0.348 . . . . 53.329999999999998 110.895 -179.892 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 136' ' ' VAL . . . . . . . . . . . . . 95.0 t -111.66 108.56 25.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.214 -0.448 . . . . 75.349999999999994 111.134 180.0 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 17.5 p30 -86.24 175.62 8.38 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.163 -0.471 . . . . 62.530000000000001 110.877 -179.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 39.6 t80 -60.94 -46.52 90.38 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.193 -0.458 . . . . 74.540000000000006 110.968 -179.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 79.4 tt0 -52.62 -36.45 56.48 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.054 -0.521 . . . . 74.25 110.878 -179.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -78.41 -40.62 35.39 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.145 -0.479 . . . . 75.329999999999998 110.872 -179.911 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 26.7 t80 -62.31 -46.92 86.56 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.177 -0.465 . . . . 74.219999999999999 110.88 -179.891 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 83.1 t -51.61 -46.93 38.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.186 -0.461 . . . . 74.230000000000004 111.164 179.917 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 3.8 tt0 -71.9 -24.96 61.74 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.175 -0.466 . . . . 71.140000000000001 110.939 179.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 7.0 tpt -74.04 -42.36 60.38 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.192 -0.458 . . . . 71.129999999999995 110.883 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -71.77 -27.7 63.14 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.238 -0.437 . . . . 72.230000000000004 110.901 179.926 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 1.8 m . . . . . 0 C--N 1.33 -0.272 0 CA-C-N 116.239 -0.437 . . . . 72.219999999999999 111.098 -179.885 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' M' M ' 15' ' ' LYS . . . . . . . . . . . . . 7.3 mtmp? . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.753 0.311 . . . . 72.519999999999996 110.917 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' M' M ' 16' ' ' TRP . . . . . . . . . . . . . 18.0 m95 -54.6 -41.14 69.57 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.149 -0.478 . . . . 73.299999999999997 110.953 179.917 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' M' M ' 17' ' ' GLU . . . . . . . . . . . . . 15.8 tt0 -57.87 -26.57 62.28 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.215 -0.448 . . . . 71.420000000000002 110.862 -179.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' M' M ' 18' ' ' LYS . . . . . . . . . . . . . 19.8 tttp -73.5 -25.75 60.58 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.165 -0.471 . . . . 64.450000000000003 110.916 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' M' M ' 19' ' ' ILE . . . . . . . . . . . . . 31.5 mt -82.63 -20.96 9.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.194 -0.457 . . . . 73.219999999999999 111.103 179.882 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' M' M ' 20' ' ' ARG . . . . . . . . . . . . . 36.6 ttm180 . . . . . 0 C--N 1.329 -0.324 0 CA-C-N 116.199 -0.455 . . . . 75.209999999999994 110.921 179.918 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' M' M ' 30' ' ' LYS . . . . . . . . . . . . . 11.4 tttm . . . . . 0 C--O 1.233 0.186 0 CA-C-O 120.791 0.329 . . . . 74.299999999999997 110.896 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' M' M ' 31' ' ' LEU . . . . . . . . . . . . . 10.0 tp 179.72 -47.87 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.265 -0.425 . . . . 74.530000000000001 110.925 179.917 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' M' M ' 32' ' ' LYS . . . . . . . . . . . . . 1.3 ttmm -48.26 -45.8 34.9 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.179 -0.464 . . . . 74.340000000000003 110.879 179.816 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' M' M ' 33' ' ' HIS . . . . . . . . . . . . . 35.1 t60 -49.99 -39.82 42.31 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.211 -0.449 . . . . 74.299999999999997 110.877 179.928 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' M' M ' 34' ' ' ILE . . . . . . . . . . . . . 58.9 mt -50.08 -40.21 16.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.197 -0.456 . . . . 73.219999999999999 111.091 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' M' M ' 35' ' ' VAL . . . . . . . . . . . . . 62.5 t -48.36 -41.29 10.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.227 -0.442 . . . . 74.420000000000002 111.101 179.864 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' M' M ' 36' ' ' TRP . . . . . . . . . . . . . 22.0 m0 -58.43 -40.47 82.6 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.217 -0.447 . . . . 73.409999999999997 110.914 179.988 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' M' M ' 37' ' ' ALA . . . . . . . . . . . . . . . -64.09 -18.85 64.79 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.201 -0.454 . . . . 63.43 111.106 179.888 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' M' M ' 38' ' ' SER . . . . . . . . . . . . . 1.1 m -69.31 -17.94 63.77 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.223 -0.444 . . . . 72.200000000000003 110.84 -179.764 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' M' M ' 39' ' ' ARG . . . . . . . . . . . . . 45.0 mtp180 -71.51 -21.76 61.88 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.163 -0.471 . . . . 74.420000000000002 110.869 -179.93 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' M' M ' 40' ' ' GLU . . . . . . . . . . . . . 22.2 mm-40 -73.94 -48.0 33.71 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.206 -0.452 . . . . 63.009999999999998 110.924 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' M' M ' 41' ' ' LEU . . . . . . . . . . . . . 13.6 mt . . . . . 0 C--N 1.328 -0.341 0 CA-C-N 116.174 -0.466 . . . . 74.010000000000005 110.939 -179.997 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 1.2 tp-100 . . . . . 0 C--O 1.232 0.147 0 CA-C-O 120.777 0.322 . . . . 74.219999999999999 110.899 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 54.6 mt -69.68 -40.12 78.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.252 -0.431 . . . . 70.450000000000003 111.156 179.931 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.63 -26.05 66.74 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.135 -0.484 . . . . 71.310000000000002 111.085 179.847 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 15.4 mm-40 -74.15 -51.93 14.07 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.261 -0.427 . . . . 73.230000000000004 110.867 -179.92 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 16.6 m-85 -69.03 -38.06 78.97 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.213 -0.449 . . . . 65.129999999999995 110.902 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 19.7 ttmt -52.09 -50.38 61.73 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.141 -0.481 . . . . 74.430000000000007 110.928 179.932 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -56.54 -37.25 70.24 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.171 -0.468 . . . . 63.329999999999998 110.885 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -59.6 -25.56 64.72 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.169 -0.469 . . . . 72.120000000000005 111.071 179.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 73.8 t80 -70.94 -54.03 12.84 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.215 -0.448 . . . . 73.540000000000006 110.842 -179.895 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 74.9 m -52.79 -31.37 38.23 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.131 -0.486 . . . . 73.329999999999998 110.892 -179.768 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 16.3 tp -63.07 -39.93 96.18 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.101 -0.499 . . . . 74.420000000000002 110.902 -179.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 33.7 m-85 -79.61 -35.88 38.86 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.213 -0.449 . . . . 72.349999999999994 110.899 179.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 16.1 t0 -67.56 98.51 0.68 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.165 -0.47 . . . . 64.040000000000006 110.919 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 3.2 tppt? -70.28 -54.31 13.22 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.209 -0.45 . . . . 74.109999999999999 110.911 -179.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 19.3 p-10 -75.73 -10.04 59.1 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.221 -0.445 . . . . 60.109999999999999 110.88 179.848 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 52.18 46.09 56.95 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.732 -0.747 . . . . 73.400000000000006 112.482 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 25.0 p-10 -93.59 -15.75 25.08 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.854 0.359 . . . . 72.200000000000003 110.891 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 100.32 18.04 22.75 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.789 -0.719 . . . . 51.130000000000003 112.479 -179.942 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -154.62 130.82 10.35 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.776 0.322 . . . . 73.510000000000005 111.142 -179.858 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 25.6 mt -94.25 119.84 42.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.205 -0.452 . . . . 74.400000000000006 111.182 179.896 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 20.2 p -107.61 176.24 5.22 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.182 -0.463 . . . . 74.239999999999995 111.166 -179.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 1.5 p -66.8 -33.95 76.74 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.26 -0.427 . . . . 72.420000000000002 111.14 -179.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 45.3 mtmt -61.44 -50.13 74.02 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.237 -0.438 . . . . 74.349999999999994 110.879 179.923 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 8.2 mt-10 -76.06 -52.88 9.24 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.244 -0.435 . . . . 72.439999999999998 110.893 179.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -53.34 -40.67 65.07 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.169 -0.468 . . . . 73.420000000000002 110.922 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -70.15 -30.66 69.5 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.785 -0.721 . . . . 72.099999999999994 112.491 179.893 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 96.6 m -74.48 -46.13 41.58 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.771 0.32 . . . . 74.310000000000002 111.12 -179.862 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 47.4 t -51.54 -47.37 36.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.233 -0.44 . . . . 75.099999999999994 111.144 179.892 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -56.22 -34.8 66.64 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.2 -0.454 . . . . 75.430000000000007 110.869 179.89 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 42.1 ttt-85 -56.41 -40.36 74.56 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.229 -0.442 . . . . 75.239999999999995 110.911 -179.912 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 5.2 t -76.54 -26.26 54.97 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.181 -0.463 . . . . 72.430000000000007 110.839 -179.807 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 60.9 mt -81.48 -21.92 38.4 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.116 -0.493 . . . . 71.099999999999994 110.933 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 101.45 31.32 5.57 Favored Glycine 0 N--CA 1.452 -0.251 0 C-N-CA 120.722 -0.751 . . . . 45.140000000000001 112.477 179.856 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 5.7 mm100 -122.62 124.82 44.35 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.796 0.331 . . . . 75.010000000000005 110.923 -179.895 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 1.1 t30 -109.87 76.58 0.97 Allowed Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.603 0.716 . . . . 74.430000000000007 110.911 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.71 167.97 22.82 Favored 'Trans proline' 0 C--O 1.232 0.177 0 C-N-CA 122.675 2.25 . . . . 72.019999999999996 112.397 179.908 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 20.0 p -110.07 154.14 23.66 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.228 -0.442 . . . . 71.099999999999994 111.138 -179.963 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 20.5 tt0 -51.91 -38.84 57.78 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.222 -0.445 . . . . 71.310000000000002 110.895 -179.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.33 -31.61 64.08 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.127 -0.488 . . . . 73.040000000000006 111.075 179.9 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -72.77 -52.6 14.39 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.209 -0.45 . . . . 65.409999999999997 110.895 -179.9 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 9.3 mt -55.15 -38.39 68.2 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.128 -0.487 . . . . 75.209999999999994 110.928 -179.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 17.7 tp60 -64.48 -31.72 73.05 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.145 -0.48 . . . . 74.439999999999998 110.935 179.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 26.4 t0 -72.65 -42.11 64.71 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.204 -0.453 . . . . 73.420000000000002 110.864 179.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 41.6 mtp -65.71 -57.4 8.12 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.179 -0.464 . . . . 74.329999999999998 110.907 179.963 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 62.0 mt -53.27 -45.64 55.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.216 -0.447 . . . . 71.25 111.155 179.941 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 83.0 m-20 -62.71 -29.76 70.9 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.204 -0.453 . . . . 73.420000000000002 110.891 179.915 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.36 -22.68 61.11 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.221 -0.445 . . . . 75.230000000000004 110.885 -179.983 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 35.7 m -112.96 6.28 8.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.128 -0.487 . . . . 75.319999999999993 111.176 179.963 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 30.2 t0 -86.15 97.75 10.51 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.137 -0.483 . . . . 73.420000000000002 110.891 179.923 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.28 -41.35 12.96 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.225 -0.443 . . . . 62.520000000000003 111.064 -179.993 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 57.7 p-10 -85.71 -0.13 54.32 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.197 -0.456 . . . . 74.120000000000005 110.872 -179.993 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 54.27 56.62 20.62 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.731 -0.747 . . . . 73.230000000000004 112.534 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 51.6 p-10 -114.4 -15.74 12.05 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.929 0.395 . . . . 75.120000000000005 110.914 -179.872 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 90.21 18.99 47.92 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.77 -0.729 . . . . 73.310000000000002 112.465 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 73.7 p -150.67 163.81 37.63 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.753 0.311 . . . . 74.049999999999997 111.131 -179.881 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 21.7 mt -97.96 111.05 26.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.207 -0.452 . . . . 74.230000000000004 111.122 179.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -78.43 -172.57 2.93 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.137 -0.483 . . . . 75.120000000000005 110.865 179.875 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.526 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 2.4 t80 -65.41 -57.67 14.17 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.623 0.725 . . . . 72.319999999999993 110.891 -179.926 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . 0.526 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 53.6 Cg_endo -69.78 -23.52 30.61 Favored 'Trans proline' 0 N--CA 1.465 -0.148 0 C-N-CA 122.717 2.278 . . . . 74.340000000000003 112.337 -180.0 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 15.2 mt-10 -64.45 -43.09 95.36 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.227 -0.442 . . . . 73.209999999999994 110.856 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 41.0 t80 -71.32 -36.76 71.71 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.148 -0.478 . . . . 73.299999999999997 110.866 -179.897 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 57.0 tp -70.87 -53.88 13.54 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.123 -0.49 . . . . 74.430000000000007 110.929 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 12.8 t -59.92 -26.83 66.25 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.148 -0.478 . . . . 63.329999999999998 111.159 179.935 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 10.1 tmm? -63.33 -51.15 67.19 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.201 -0.454 . . . . 70.150000000000006 110.86 179.923 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -50.89 -45.68 60.2 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.252 -0.431 . . . . 74.510000000000005 110.883 179.936 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.194 -0.457 . . . . 71.540000000000006 111.113 179.929 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 39.1 mt . . . . . 0 N--CA 1.457 -0.099 0 CA-C-O 120.823 0.344 . . . . 74.219999999999999 111.13 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 13.9 ttt180 -59.95 -41.72 92.47 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.17 -0.468 . . . . 72.319999999999993 110.867 179.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -52.11 -47.86 65.06 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.213 -0.449 . . . . 74.540000000000006 110.872 -179.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -74.55 -50.04 19.57 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.134 -0.485 . . . . 75.439999999999998 111.087 179.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 4.3 t80 -51.92 -34.53 42.01 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.231 -0.441 . . . . 73.430000000000007 110.838 -179.902 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -72.93 -46.01 54.89 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.156 -0.475 . . . . 73.349999999999994 110.903 -179.884 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 65.1 t -61.16 -31.01 48.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.181 -0.463 . . . . 74.5 111.156 179.922 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 21.0 m-85 -86.42 -44.07 12.32 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.156 -0.475 . . . . 74.150000000000006 110.93 179.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 44.2 t0 -67.78 87.95 0.24 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.123 -0.489 . . . . 64.310000000000002 110.866 179.979 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 2.3 tppt? -78.56 -47.16 17.79 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.212 -0.449 . . . . 72.510000000000005 110.863 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 9.5 p30 -72.65 -9.06 58.16 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.236 -0.438 . . . . 75.420000000000002 110.858 179.901 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 60.35 31.16 73.02 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.729 -0.748 . . . . 62.310000000000002 112.487 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 34.0 p-10 -81.89 -16.15 51.59 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.863 0.363 . . . . 75.230000000000004 110.879 -179.87 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 81.88 18.65 67.22 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.681 -0.771 . . . . 64.329999999999998 112.479 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 14.1 m-85 -142.49 142.93 32.36 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.852 0.358 . . . . 74.310000000000002 110.887 -179.808 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 62.3 mt -108.0 130.49 60.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.072 -0.513 . . . . 75.209999999999994 111.13 179.945 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 96.6 p -115.24 -171.76 2.01 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.201 -0.454 . . . . 71.349999999999994 110.86 -179.908 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -76.15 -40.12 53.38 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.136 -0.484 . . . . 73.329999999999998 111.079 179.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -64.16 -37.95 89.31 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.168 -0.469 . . . . 75.099999999999994 111.106 179.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 56.6 mt-10 -67.83 -50.27 57.64 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.221 -0.445 . . . . 74.299999999999997 110.885 -179.948 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 22.1 tp -55.25 -54.86 38.08 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.12 -0.491 . . . . 74.5 110.877 -179.938 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 37.0 ttp180 -52.24 -44.81 65.04 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.224 -0.443 . . . . 75.319999999999993 110.884 179.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 67.3 t60 -59.48 -34.38 72.5 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.149 -0.478 . . . . 75.230000000000004 110.892 179.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 21.7 t -74.49 -52.37 19.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.196 -0.456 . . . . 73.329999999999998 111.142 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -60.41 -41.94 94.97 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.148 -0.478 . . . . 74.450000000000003 110.901 179.896 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 11.3 p -53.51 -32.35 50.0 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.192 -0.458 . . . . 75.099999999999994 111.088 -179.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 22.6 t-20 -74.6 -29.41 61.3 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.243 -0.435 . . . . 74.420000000000002 110.876 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 2.1 mt -70.68 -24.36 62.66 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.219 -0.446 . . . . 74.439999999999998 110.905 179.944 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 101.02 32.93 5.14 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.765 -0.731 . . . . 64.030000000000001 112.531 179.924 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -112.4 114.54 27.31 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.917 0.389 . . . . 71.510000000000005 110.874 -179.832 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 3.2 ttpm? -64.61 123.35 19.07 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.158 -0.474 . . . . 75.430000000000007 110.881 179.947 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 8.5 mt -141.34 155.79 45.91 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.181 -0.463 . . . . 74.049999999999997 110.926 179.901 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 30.3 p -118.87 167.47 11.68 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.227 -0.442 . . . . 75.019999999999996 111.177 179.911 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 69.8 m-20 -51.98 -37.53 53.43 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.218 -0.447 . . . . 73.329999999999998 110.852 179.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -72.67 -34.85 67.5 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.2 -0.454 . . . . 74.439999999999998 110.881 -179.891 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -64.91 -45.87 84.1 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.178 -0.465 . . . . 61.43 110.842 -179.917 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 88.9 t -56.21 -30.65 30.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.179 -0.464 . . . . 74.209999999999994 111.153 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 54.8 t0 -66.52 -45.67 78.73 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.173 -0.467 . . . . 73.140000000000001 110.864 179.921 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -55.82 -29.48 59.86 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.213 -0.449 . . . . 72.109999999999999 110.906 -179.914 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 25.1 mtp -75.76 -59.51 2.72 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.171 -0.468 . . . . 74.530000000000001 110.896 179.935 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 34.2 mm -54.08 -35.61 29.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.243 -0.435 . . . . 73.25 111.156 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 4.9 tmm_? -66.3 -31.72 72.69 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.135 -0.484 . . . . 75.299999999999997 110.873 179.953 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -70.67 -48.22 55.93 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.231 -0.44 . . . . 74.239999999999995 110.897 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -73.12 -33.05 65.32 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.175 -0.466 . . . . 72.299999999999997 111.1 179.931 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 50.6 t0 -69.18 86.31 0.39 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.196 -0.456 . . . . 71.400000000000006 110.898 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 3.5 mt -79.95 -45.24 22.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.219 -0.446 . . . . 75.450000000000003 111.131 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 23.3 p30 -72.65 -8.9 57.6 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.188 -0.46 . . . . 74.030000000000001 110.881 179.855 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 62.94 45.36 95.82 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.747 -0.74 . . . . 52.420000000000002 112.506 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 31.6 p-10 -91.65 -16.15 27.46 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.894 0.378 . . . . 73.129999999999995 110.885 -179.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 101.94 3.8 51.7 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.73 -0.747 . . . . 64.409999999999997 112.489 -179.937 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 5.8 tt0 -149.34 172.31 15.11 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.832 0.349 . . . . 71.120000000000005 110.917 -179.882 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 136' ' ' VAL . . . . . . . . . . . . . 67.8 t -115.55 114.29 45.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.185 -0.461 . . . . 74.340000000000003 111.099 179.967 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 48.4 p-10 -94.01 -172.41 2.83 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.123 -0.489 . . . . 73.209999999999994 110.899 179.979 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 47.5 t80 -68.46 -49.26 61.15 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.185 -0.461 . . . . 74.140000000000001 110.918 -179.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -51.63 -46.68 63.73 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.172 -0.467 . . . . 75.319999999999993 110.884 179.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -70.87 -40.86 72.03 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.162 -0.472 . . . . 73.439999999999998 110.929 -179.949 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 88.0 t80 -59.68 -35.5 74.58 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.12 -0.491 . . . . 70.319999999999993 110.917 -179.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 94.2 t -64.1 -37.52 80.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.104 -0.498 . . . . 54.210000000000001 111.112 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 16.4 tm0? -70.34 -33.13 71.11 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.152 -0.477 . . . . 75.120000000000005 110.951 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 8.8 tpt -74.71 -56.31 4.93 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.225 -0.443 . . . . 75.209999999999994 110.885 179.919 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 5.0 ttm -60.54 -27.91 68.02 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.216 -0.447 . . . . 73.430000000000007 110.906 179.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 2.5 m . . . . . 0 C--N 1.329 -0.286 0 CA-C-N 116.209 -0.45 . . . . 70.340000000000003 111.116 -179.924 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' M' M ' 15' ' ' LYS . . . . . . . . . . . . . 19.2 mtmm . . . . . 0 C--O 1.231 0.099 0 CA-C-O 120.774 0.321 . . . . 72.209999999999994 110.894 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' M' M ' 16' ' ' TRP . . . . . . . . . . . . . 17.9 m95 -52.06 -47.21 65.23 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.251 -0.432 . . . . 71.310000000000002 110.943 179.934 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' M' M ' 17' ' ' GLU . . . . . . . . . . . . . 18.1 tt0 -57.47 -26.22 60.92 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.282 -0.417 . . . . 74.510000000000005 110.892 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' M' M ' 18' ' ' LYS . . . . . . . . . . . . . 6.0 ttpm? -73.06 -25.8 61.05 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.11 -0.496 . . . . 73.319999999999993 110.885 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' M' M ' 19' ' ' ILE . . . . . . . . . . . . . 28.7 mt -76.64 -21.79 14.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.253 -0.431 . . . . 72.099999999999994 111.116 179.896 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' M' M ' 20' ' ' ARG . . . . . . . . . . . . . 43.1 ttt180 . . . . . 0 C--N 1.329 -0.285 0 CA-C-N 116.187 -0.46 . . . . 75.099999999999994 110.859 179.931 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' M' M ' 30' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.232 0.154 0 CA-C-O 120.789 0.328 . . . . 74.329999999999998 110.878 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' M' M ' 31' ' ' LEU . . . . . . . . . . . . . 12.3 tp -136.73 -41.25 0.61 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.226 -0.443 . . . . 62.100000000000001 110.924 179.886 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' M' M ' 32' ' ' LYS . . . . . . . . . . . . . 12.2 ptmm? -47.13 -42.15 18.79 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.247 -0.433 . . . . 75.340000000000003 110.911 179.791 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' M' M ' 33' ' ' HIS . . . . . . . . . . . . . 19.4 t60 -49.12 -44.4 42.33 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.218 -0.446 . . . . 75.209999999999994 110.843 179.871 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' M' M ' 34' ' ' ILE . . . . . . . . . . . . . 77.7 mt -51.54 -38.34 20.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.199 -0.455 . . . . 73.140000000000001 111.168 179.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' M' M ' 35' ' ' VAL . . . . . . . . . . . . . 38.1 t -50.14 -39.17 15.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.195 -0.457 . . . . 73.519999999999996 111.08 179.872 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' M' M ' 36' ' ' TRP . . . . . . . . . . . . . 22.5 m0 -59.06 -39.13 81.11 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.182 -0.463 . . . . 75.219999999999999 110.907 179.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' M' M ' 37' ' ' ALA . . . . . . . . . . . . . . . -64.22 -18.52 64.59 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.222 -0.445 . . . . 74.420000000000002 111.099 179.939 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' M' M ' 38' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -73.13 -17.87 61.35 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.215 -0.448 . . . . 70.010000000000005 110.817 -179.744 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' M' M ' 39' ' ' ARG . . . . . . . . . . . . . 1.4 tpt180 -58.68 -25.6 63.0 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.165 -0.47 . . . . 74.510000000000005 110.897 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' M' M ' 40' ' ' GLU . . . . . . . . . . . . . 2.4 pt-20 -87.07 -27.89 22.88 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.142 -0.481 . . . . 72.230000000000004 110.894 -179.939 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' M' M ' 41' ' ' LEU . . . . . . . . . . . . . 11.3 mt . . . . . 0 C--N 1.329 -0.32 0 CA-C-N 116.147 -0.478 . . . . 73.219999999999999 110.923 179.993 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 24.6 tt0 . . . . . 0 C--O 1.232 0.15 0 CA-C-O 120.764 0.316 . . . . 74.420000000000002 110.904 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 3.2 mp -62.66 -52.33 61.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.235 -0.439 . . . . 75.219999999999999 111.077 -179.976 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -52.0 -33.76 39.74 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.187 -0.461 . . . . 74.450000000000003 111.114 179.8 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -74.9 -51.66 13.28 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.192 -0.458 . . . . 72.209999999999994 110.864 -179.897 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 16.5 m-85 -58.2 -42.22 85.69 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.17 -0.468 . . . . 71.340000000000003 110.891 -179.899 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -51.91 -37.85 54.04 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.131 -0.486 . . . . 72.409999999999997 110.892 179.986 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 -66.13 -35.83 81.52 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.252 -0.431 . . . . 64.209999999999994 110.831 179.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -65.63 -41.06 93.08 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.164 -0.471 . . . . 73.140000000000001 111.078 179.943 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 85.3 t80 -53.4 -51.58 62.1 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.253 -0.43 . . . . 72.439999999999998 110.881 -179.927 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 14.7 p -53.23 -32.71 49.63 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.176 -0.465 . . . . 72.319999999999993 110.857 -179.824 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 17.5 tp -64.58 -38.92 92.68 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.141 -0.481 . . . . 74.25 110.879 -179.991 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 48.1 m-85 -82.04 -27.65 32.92 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.233 -0.44 . . . . 75.120000000000005 110.888 179.966 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -82.83 98.56 9.21 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.164 -0.471 . . . . 72.120000000000005 110.835 179.962 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 40.4 mmtt -69.91 -54.14 14.73 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.197 -0.456 . . . . 73.349999999999994 110.878 179.969 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 22.3 p-10 -77.2 -10.12 59.21 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.215 -0.448 . . . . 72.409999999999997 110.879 179.879 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 52.02 42.26 54.07 Favored Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.726 -0.75 . . . . 73.409999999999997 112.453 -179.959 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 29.9 p-10 -88.57 -15.66 34.53 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.872 0.367 . . . . 71.109999999999999 110.882 -179.998 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 105.4 -11.74 47.36 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.723 -0.751 . . . . 74.120000000000005 112.463 -179.965 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 34.0 p -125.8 130.78 52.1 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.723 0.297 . . . . 65.219999999999999 111.168 -179.818 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 25.0 mt -98.58 125.98 51.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.241 -0.436 . . . . 74.439999999999998 111.108 179.969 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 73.9 p -111.41 -178.51 3.47 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.188 -0.46 . . . . 72.310000000000002 111.1 -179.998 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 2.0 p -66.57 -26.76 67.27 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.214 -0.448 . . . . 75.120000000000005 111.147 -179.966 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 2.2 tppp? -75.07 -50.19 17.25 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.224 -0.444 . . . . 75.329999999999998 110.883 179.878 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 28.4 mt-10 -71.32 -40.38 70.8 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.266 -0.425 . . . . 74.150000000000006 110.843 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 3.9 tt -74.07 -49.19 25.18 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.199 -0.455 . . . . 74.109999999999999 110.921 -179.988 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -54.25 -27.94 41.13 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.771 -0.728 . . . . 73.010000000000005 112.453 179.93 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 95.1 m -68.97 -53.47 20.53 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.827 0.346 . . . . 75.140000000000001 111.095 -179.828 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 39.2 t -51.76 -51.42 27.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.223 -0.444 . . . . 73.349999999999994 111.172 179.89 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 7.5 mtt -54.21 -49.14 70.09 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.126 -0.488 . . . . 73.329999999999998 110.859 179.94 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 2.6 tmt_? -59.1 -42.6 90.87 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.205 -0.452 . . . . 72.109999999999999 110.887 -179.929 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 4.2 t -57.5 -29.9 64.68 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.14 -0.482 . . . . 72.409999999999997 110.859 -179.785 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 9.3 mt -91.91 -4.38 54.78 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.13 -0.486 . . . . 74.109999999999999 110.957 179.988 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 101.42 -13.15 58.4 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.738 -0.744 . . . . 73.150000000000006 112.523 179.943 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -81.48 96.27 7.35 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.855 0.359 . . . . 71.420000000000002 110.917 -179.883 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 6.4 t-20 -109.74 82.67 2.4 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.672 0.749 . . . . 75.019999999999996 110.874 -179.952 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.8 168.05 22.72 Favored 'Trans proline' 0 C--N 1.342 0.187 0 C-N-CA 122.719 2.279 . . . . 75.140000000000001 112.332 179.949 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 20.0 p -83.98 158.35 21.55 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.224 -0.443 . . . . 72.349999999999994 111.128 -179.947 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 15.1 mp0 -51.97 -48.36 64.38 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.228 -0.442 . . . . 71.040000000000006 110.914 179.98 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.78 -31.55 72.59 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.159 -0.473 . . . . 63.409999999999997 111.062 179.967 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -68.28 -52.0 38.73 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.259 -0.428 . . . . 74.439999999999998 110.915 -179.908 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 25.3 mt -55.09 -48.67 73.24 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.122 -0.49 . . . . 72.129999999999995 110.904 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 17.5 tp60 -54.4 -29.43 48.93 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.212 -0.449 . . . . 64.5 110.91 179.932 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 46.1 t0 -74.49 -29.53 61.46 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.189 -0.46 . . . . 73.420000000000002 110.862 179.989 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 41.5 mtp -73.14 -58.06 3.58 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.174 -0.467 . . . . 70.340000000000003 110.857 -179.974 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 62.0 mt -53.32 -52.75 28.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.22 -0.446 . . . . 72.200000000000003 111.105 179.981 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 78.4 m-20 -57.0 -25.28 58.21 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.236 -0.438 . . . . 71.519999999999996 110.894 179.967 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -75.54 -28.33 59.02 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.145 -0.48 . . . . 64.25 110.87 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 9.8 m -109.81 10.87 8.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.164 -0.471 . . . . 60.530000000000001 111.104 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 28.8 t0 -86.69 99.99 12.15 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.199 -0.455 . . . . 62.039999999999999 110.869 179.89 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.3 -46.87 8.85 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.163 -0.471 . . . . 70.349999999999994 111.126 179.911 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 50.7 p30 -81.63 -0.3 41.84 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.226 -0.443 . . . . 72.340000000000003 110.88 -179.998 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 55.26 55.47 28.19 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.734 -0.746 . . . . 53.340000000000003 112.517 -179.916 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 50.3 p-10 -114.55 -15.76 11.97 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.863 0.363 . . . . 73.420000000000002 110.872 -179.858 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 89.39 20.46 44.98 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.705 -0.76 . . . . 64.329999999999998 112.527 -179.981 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 71.4 p -150.49 161.1 43.18 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.723 0.296 . . . . 73.530000000000001 111.117 -179.814 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 22.9 mt -98.98 114.59 37.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.214 -0.448 . . . . 75.310000000000002 111.151 179.882 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.4 t0 -82.33 -172.84 4.22 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.213 -0.449 . . . . 74.439999999999998 110.86 179.902 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.519 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 2.4 t80 -65.1 -58.21 13.23 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.65 0.738 . . . . 72.409999999999997 110.867 -179.89 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . 0.519 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 53.9 Cg_endo -69.74 -24.26 29.98 Favored 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.674 2.25 . . . . 64.510000000000005 112.315 -179.968 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 75.9 mt-10 -65.29 -41.78 93.8 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.254 -0.43 . . . . 75.310000000000002 110.917 -179.964 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 26.5 t80 -72.54 -36.11 68.19 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.148 -0.478 . . . . 63.520000000000003 110.863 -179.932 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 50.2 tp -68.98 -53.67 19.39 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.137 -0.483 . . . . 74.349999999999994 110.901 -179.973 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 13.3 t -58.44 -26.67 63.58 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.242 -0.436 . . . . 74.209999999999994 111.137 179.936 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 5.3 tmm? -62.25 -50.41 71.84 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.243 -0.435 . . . . 75.349999999999994 110.868 179.94 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 1.2 mmt -51.61 -45.39 63.2 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.215 -0.448 . . . . 74.219999999999999 110.88 179.951 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.313 0 CA-C-N 116.238 -0.437 . . . . 62.210000000000001 111.1 179.967 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 61.9 mt . . . . . 0 C--O 1.231 0.112 0 CA-C-O 120.85 0.357 . . . . 72.230000000000004 111.142 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 53.6 ttp180 -72.02 -32.92 67.63 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.193 -0.458 . . . . 75.019999999999996 110.871 179.975 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 24.9 mm-40 -76.56 -48.29 19.78 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.165 -0.471 . . . . 74.409999999999997 110.939 -179.975 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -53.37 -43.01 67.44 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.182 -0.463 . . . . 74.340000000000003 111.122 179.883 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 36.0 t80 -52.01 -37.28 52.76 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.244 -0.434 . . . . 74.109999999999999 110.875 -179.937 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 3.4 tmt_? -71.0 -38.67 72.66 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.128 -0.487 . . . . 74.329999999999998 110.845 -179.888 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 31.5 t -62.21 -48.13 89.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.196 -0.456 . . . . 75.420000000000002 111.13 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 9.9 m-85 -68.3 -26.3 65.57 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.186 -0.461 . . . . 73.150000000000006 110.875 -179.987 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 37.6 t0 -72.84 92.81 1.63 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.151 -0.477 . . . . 75.409999999999997 110.873 179.948 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 34.4 ttmt -78.57 -51.02 10.53 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.192 -0.458 . . . . 74.239999999999995 110.882 179.985 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 24.0 p30 -72.44 -9.1 58.11 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.228 -0.442 . . . . 61.329999999999998 110.866 179.87 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 60.0 29.37 67.86 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.779 -0.724 . . . . 70.120000000000005 112.482 -179.951 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 42.6 p-10 -82.98 -16.15 48.37 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.91 0.386 . . . . 73.430000000000007 110.908 -179.884 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 93.66 18.7 37.13 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.709 -0.757 . . . . 74.209999999999994 112.469 179.965 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 21.8 m-85 -139.26 165.56 26.86 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.884 0.373 . . . . 74.299999999999997 110.909 -179.799 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 77.5 mt -122.37 114.56 43.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.135 -0.484 . . . . 63.409999999999997 111.126 179.91 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 4.9 p -102.52 174.93 5.68 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.174 -0.466 . . . . 72.530000000000001 110.906 -179.927 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -67.73 -30.2 69.62 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.191 -0.459 . . . . 61.009999999999998 111.124 179.889 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -68.13 -43.91 77.27 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.17 -0.468 . . . . 73.109999999999999 111.15 179.912 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 91.0 mt-10 -74.13 -47.68 34.52 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.193 -0.458 . . . . 71.439999999999998 110.875 -179.934 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 34.8 tp -53.86 -49.78 67.72 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.159 -0.473 . . . . 73.209999999999994 110.916 -179.944 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 26.3 ttt180 -52.25 -41.62 62.96 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.191 -0.458 . . . . 75.439999999999998 110.876 179.923 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 27.3 t60 -59.74 -34.47 72.99 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.232 -0.44 . . . . 75.209999999999994 110.903 179.984 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 38.3 t -66.86 -45.71 86.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.193 -0.458 . . . . 73.230000000000004 111.153 179.956 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 3.4 mmt -60.59 -37.0 79.91 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.186 -0.461 . . . . 71.430000000000007 110.85 179.939 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 2.1 m -55.03 -34.33 63.41 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.236 -0.438 . . . . 71.040000000000006 111.152 -179.948 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 4.9 t-20 -70.96 -30.69 67.05 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.22 -0.446 . . . . 73.409999999999997 110.87 179.974 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 18.1 mt -73.01 -26.28 61.27 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.189 -0.46 . . . . 71.439999999999998 110.918 179.967 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 99.9 30.13 6.56 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.767 -0.73 . . . . 73.439999999999998 112.465 179.874 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -115.14 112.69 22.94 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.915 0.388 . . . . 63.009999999999998 110.87 -179.876 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.57 119.77 12.28 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.127 -0.488 . . . . 62.219999999999999 110.87 179.951 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 7.8 mt -140.49 155.82 46.54 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.215 -0.448 . . . . 74.450000000000003 110.891 179.883 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 52.5 p -115.03 170.54 8.27 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.181 -0.463 . . . . 74.109999999999999 111.141 179.958 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 20.6 m-20 -58.71 -33.21 69.94 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.215 -0.448 . . . . 75.409999999999997 110.857 179.909 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 22.5 tp10 -75.68 -33.46 60.39 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.184 -0.462 . . . . 74.519999999999996 110.865 -179.882 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 13.7 tt0 -71.15 -31.77 68.12 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.171 -0.468 . . . . 75.150000000000006 110.856 -179.914 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 43.5 t -71.27 -31.96 45.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.187 -0.461 . . . . 73.049999999999997 111.153 179.963 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 12.2 t0 -51.98 -46.86 65.02 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.137 -0.483 . . . . 71.120000000000005 110.811 179.954 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 20.6 tp10 -55.82 -29.33 59.6 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.214 -0.448 . . . . 73.310000000000002 110.877 -179.859 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 71.7 mtp -75.55 -59.48 2.73 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.144 -0.48 . . . . 73.540000000000006 110.903 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 35.9 mm -53.93 -35.7 28.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.243 -0.435 . . . . 71.209999999999994 111.165 179.898 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 56.8 ttt180 -63.49 -31.85 73.13 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.152 -0.476 . . . . 73.129999999999995 110.915 179.932 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -74.66 -52.37 11.83 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.139 -0.482 . . . . 74.329999999999998 110.864 -179.892 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -65.23 -34.49 78.48 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.102 -0.499 . . . . 74.239999999999995 111.099 179.925 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 49.4 t0 -68.45 86.74 0.3 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.26 -0.427 . . . . 74.540000000000006 110.864 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 55.2 mt -79.83 -46.13 22.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.166 -0.47 . . . . 72.140000000000001 111.141 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 21.3 p30 -72.8 -8.74 56.94 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.181 -0.463 . . . . 73.340000000000003 110.875 179.864 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 62.76 42.59 99.66 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.703 -0.761 . . . . 74.129999999999995 112.476 -179.917 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 34.6 p-10 -87.58 -16.0 35.8 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.864 0.364 . . . . 71.340000000000003 110.919 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 104.12 2.37 45.11 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.745 -0.741 . . . . 74.439999999999998 112.431 -179.988 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 4.0 tt0 -149.16 172.27 15.09 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.901 0.382 . . . . 73.409999999999997 110.894 -179.921 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 136' ' ' VAL . . . . . . . . . . . . . 99.3 t -107.33 111.25 34.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.21 -0.45 . . . . 75.430000000000007 111.127 179.98 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 19.0 p30 -92.11 165.59 13.08 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.15 -0.477 . . . . 74.150000000000006 110.881 -179.993 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 37.0 t80 -52.01 -46.89 65.15 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.162 -0.472 . . . . 75.310000000000002 110.983 -179.919 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 15.3 tt0 -51.94 -42.14 62.6 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.077 -0.51 . . . . 65.340000000000003 110.943 179.965 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 23.7 mt-10 -76.52 -34.27 58.58 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.108 -0.497 . . . . 71.409999999999997 110.92 -179.951 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 43.2 t80 -65.74 -38.93 90.48 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.121 -0.49 . . . . 74.150000000000006 110.855 -179.897 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 98.9 t -71.34 -40.6 73.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.121 -0.491 . . . . 64.299999999999997 111.123 -179.989 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 24.4 tt0 -70.83 -45.31 64.78 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.173 -0.467 . . . . 65.230000000000004 110.911 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 11.4 tpt -65.0 -26.2 68.19 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.172 -0.467 . . . . 73.049999999999997 110.87 180.0 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 6.4 ttm -87.61 -39.47 15.04 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.25 -0.432 . . . . 74.209999999999994 110.887 179.916 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 2.6 m . . . . . 0 C--N 1.329 -0.286 0 CA-C-N 116.197 -0.456 . . . . 72.430000000000007 111.113 -179.87 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' M' M ' 15' ' ' LYS . . . . . . . . . . . . . 44.7 mttp . . . . . 0 C--O 1.231 0.112 0 CA-C-O 120.779 0.323 . . . . 71.209999999999994 110.888 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' M' M ' 16' ' ' TRP . . . . . . . . . . . . . 10.2 m95 -54.09 -39.03 65.96 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.241 -0.436 . . . . 74.299999999999997 110.919 179.923 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' M' M ' 17' ' ' GLU . . . . . . . . . . . . . 15.3 tm-20 -56.9 -27.8 61.15 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.227 -0.442 . . . . 74.420000000000002 110.872 -179.929 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' M' M ' 18' ' ' LYS . . . . . . . . . . . . . 6.9 ttpm? -73.45 -26.95 61.16 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.153 -0.476 . . . . 75.420000000000002 110.913 179.953 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' M' M ' 19' ' ' ILE . . . . . . . . . . . . . 27.6 mt -93.02 -23.45 5.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.25 -0.432 . . . . 71.140000000000001 111.169 179.848 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' M' M ' 20' ' ' ARG . . . . . . . . . . . . . 25.5 ttp85 . . . . . 0 C--N 1.329 -0.284 0 CA-C-N 116.193 -0.458 . . . . 74.340000000000003 110.846 179.972 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' M' M ' 30' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.232 0.181 0 CA-C-O 120.798 0.332 . . . . 74.140000000000001 110.896 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' M' M ' 31' ' ' LEU . . . . . . . . . . . . . 10.9 tp -147.95 -46.56 0.16 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.253 -0.431 . . . . 70.409999999999997 110.898 179.984 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' M' M ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.45 -32.83 8.31 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.169 -0.469 . . . . 75.109999999999999 110.919 179.866 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' M' M ' 33' ' ' HIS . . . . . . . . . . . . . 77.6 t60 -47.99 -47.17 33.23 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.226 -0.443 . . . . 72.409999999999997 110.846 179.919 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' M' M ' 34' ' ' ILE . . . . . . . . . . . . . 3.6 mp -51.73 -38.75 22.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.169 -0.469 . . . . 75.310000000000002 111.137 179.967 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' M' M ' 35' ' ' VAL . . . . . . . . . . . . . 47.1 t -49.01 -39.63 12.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.203 -0.453 . . . . 74.200000000000003 111.138 179.826 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' M' M ' 36' ' ' TRP . . . . . . . . . . . . . 20.9 m0 -59.19 -40.21 85.03 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.197 -0.456 . . . . 73.310000000000002 110.923 179.972 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' M' M ' 37' ' ' ALA . . . . . . . . . . . . . . . -63.01 -18.77 63.68 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.231 -0.44 . . . . 73.019999999999996 111.09 179.912 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' M' M ' 38' ' ' SER . . . . . . . . . . . . . 5.0 m -64.92 -17.8 64.66 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.207 -0.451 . . . . 64.129999999999995 110.886 -179.803 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' M' M ' 39' ' ' ARG . . . . . . . . . . . . . 52.3 mtp180 -52.12 -29.2 20.77 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.123 -0.49 . . . . 74.430000000000007 110.88 -179.931 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' M' M ' 40' ' ' GLU . . . . . . . . . . . . . 17.7 tp10 -90.05 -48.08 7.42 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.205 -0.452 . . . . 71.299999999999997 110.887 -179.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' M' M ' 41' ' ' LEU . . . . . . . . . . . . . 6.8 mt . . . . . 0 C--N 1.328 -0.333 0 CA-C-N 116.132 -0.485 . . . . 74.299999999999997 110.9 -179.958 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 32.4 tt0 . . . . . 0 C--O 1.231 0.094 0 CA-C-O 120.803 0.335 . . . . 74.030000000000001 110.921 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 54.3 mt -72.69 -45.8 56.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.184 -0.462 . . . . 73.239999999999995 111.105 179.962 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -52.0 -29.54 21.26 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.23 -0.441 . . . . 74.040000000000006 111.087 179.818 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 41.3 tp10 -73.87 -38.39 64.45 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.263 -0.426 . . . . 74.420000000000002 110.93 -179.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 30.3 m-85 -75.82 -46.02 32.76 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.108 -0.496 . . . . 74.530000000000001 110.854 -179.933 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 35.1 ttmt -60.63 -35.47 76.26 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.175 -0.466 . . . . 72.310000000000002 110.955 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 23.0 mt-10 -58.62 -37.73 76.51 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.228 -0.442 . . . . 75.400000000000006 110.911 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -71.43 -43.94 65.79 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.126 -0.488 . . . . 73.140000000000001 111.096 179.913 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 92.6 t80 -55.49 -53.97 49.76 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.254 -0.43 . . . . 74.439999999999998 110.868 -179.912 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 12.6 t -52.43 -30.41 29.34 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.177 -0.465 . . . . 74.040000000000006 110.887 -179.799 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 15.6 tp -65.71 -42.19 91.43 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.099 -0.5 . . . . 75.230000000000004 110.878 -179.968 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 43.1 m-85 -75.43 -25.46 57.51 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.181 -0.463 . . . . 74.040000000000006 110.866 179.948 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 20.9 t0 -84.02 98.54 9.89 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.167 -0.469 . . . . 64.140000000000001 110.85 179.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 15.7 ttmm -71.11 -55.51 8.04 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.167 -0.47 . . . . 73.349999999999994 110.906 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 22.5 p-10 -72.19 -10.15 59.4 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.225 -0.443 . . . . 74.120000000000005 110.833 179.909 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 51.82 42.14 52.53 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.777 -0.725 . . . . 74.510000000000005 112.506 -179.9 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 27.5 p-10 -88.44 -15.8 34.48 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.824 0.345 . . . . 73.340000000000003 110.814 -179.967 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 104.98 -7.14 44.17 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.776 -0.726 . . . . 74.439999999999998 112.496 -179.907 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 2.8 p -131.79 130.83 42.34 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.737 0.304 . . . . 75.319999999999993 111.168 -179.862 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 28.7 mt -93.69 120.32 42.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.191 -0.459 . . . . 73.510000000000005 111.143 179.91 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 20.3 p -101.43 175.46 5.56 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.164 -0.471 . . . . 74.540000000000006 111.146 179.948 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 33.7 p -62.36 -24.97 67.66 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.185 -0.461 . . . . 74.400000000000006 111.146 -179.97 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 31.3 mttm -73.09 -50.1 24.78 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.215 -0.448 . . . . 72.549999999999997 110.898 179.901 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -73.74 -32.69 63.98 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.255 -0.43 . . . . 74.530000000000001 110.883 179.975 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -73.51 -40.87 63.71 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.16 -0.473 . . . . 73.540000000000006 110.919 179.99 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -71.73 -40.52 58.3 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.736 -0.745 . . . . 74.430000000000007 112.51 179.923 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 96.7 m -59.6 -56.09 26.24 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.825 0.345 . . . . 75.120000000000005 111.107 -179.852 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 97.4 t -51.44 -50.11 29.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.247 -0.433 . . . . 73.219999999999999 111.139 179.908 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 3.0 mtp -52.07 -32.1 33.22 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.125 -0.489 . . . . 74.299999999999997 110.901 179.918 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 40.8 ttt-85 -64.4 -48.23 76.19 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.207 -0.451 . . . . 72.150000000000006 110.868 -179.919 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 2.2 p -59.42 -28.81 67.27 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.176 -0.466 . . . . 71.230000000000004 110.834 -179.775 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 32.8 mt -80.32 -16.27 54.98 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.183 -0.462 . . . . 73.239999999999995 110.928 179.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 101.58 27.11 7.31 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.721 -0.752 . . . . 71.409999999999997 112.487 179.927 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 5.2 mt-30 -119.69 135.42 54.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.802 0.334 . . . . 74.0 110.894 -179.845 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 32.5 t-20 -109.79 76.76 0.97 Allowed Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 121.627 0.727 . . . . 71.209999999999994 110.914 -179.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.75 149.73 67.35 Favored 'Trans proline' 0 C--O 1.232 0.191 0 C-N-CA 122.634 2.223 . . . . 63.409999999999997 112.375 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 20.9 p -99.15 176.77 5.43 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.23 -0.441 . . . . 74.540000000000006 111.109 -179.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 36.1 mm-40 -64.83 -47.02 79.47 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.185 -0.461 . . . . 74.439999999999998 110.949 179.94 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.4 -38.94 65.43 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.158 -0.474 . . . . 73.430000000000007 111.047 179.94 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 13.2 tt0 -55.8 -52.65 63.24 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.267 -0.424 . . . . 75.219999999999999 110.896 -179.916 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 9.2 mt -57.59 -52.19 66.43 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.15 -0.477 . . . . 73.099999999999994 110.948 179.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.2 mm-40 -56.97 -28.5 62.36 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.21 -0.45 . . . . 72.530000000000001 110.88 179.933 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -63.98 -49.57 71.97 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.199 -0.455 . . . . 73.239999999999995 110.881 179.998 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 6.7 ptp -75.71 -37.49 59.4 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.233 -0.439 . . . . 74.409999999999997 110.878 179.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 79.2 mt -65.31 -47.49 86.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.23 -0.441 . . . . 75.430000000000007 111.138 179.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 85.2 m-20 -58.39 -33.58 69.78 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.147 -0.479 . . . . 73.340000000000003 110.895 179.921 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 15.0 mm-40 -62.41 -51.02 69.2 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.178 -0.464 . . . . 74.319999999999993 110.901 -179.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 17.6 m -77.98 -15.0 14.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.125 -0.489 . . . . 74.230000000000004 111.143 179.97 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 39.1 t0 -66.75 95.19 0.34 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.172 -0.467 . . . . 64.530000000000001 110.89 179.877 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.26 -35.3 17.36 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.166 -0.47 . . . . 73.430000000000007 111.101 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -88.22 -0.13 56.76 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.199 -0.455 . . . . 75.010000000000005 110.852 -179.998 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 52.79 58.95 9.99 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.726 -0.749 . . . . 50.539999999999999 112.495 -179.954 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 51.8 p-10 -114.63 -15.78 11.92 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.836 0.351 . . . . 75.129999999999995 110.888 -179.899 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 93.25 18.54 38.91 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.755 -0.736 . . . . 74.299999999999997 112.471 179.961 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 63.9 p -150.76 170.77 18.44 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.754 0.312 . . . . 75.219999999999999 111.153 -179.855 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 21.5 mt -102.47 109.53 26.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.257 -0.429 . . . . 74.310000000000002 111.132 179.942 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -74.13 -172.86 1.48 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.18 -0.464 . . . . 73.299999999999997 110.869 179.866 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.526 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 2.5 t80 -65.38 -58.05 13.16 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.647 0.737 . . . . 73.25 110.908 -179.923 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . 0.526 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 53.2 Cg_endo -69.75 -25.92 28.14 Favored 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.725 2.283 . . . . 70.109999999999999 112.317 -179.97 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -63.23 -39.98 96.17 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.211 -0.45 . . . . 74.150000000000006 110.879 -179.956 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 44.9 t80 -74.5 -35.94 63.23 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.132 -0.485 . . . . 74.420000000000002 110.883 -179.909 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 21.9 tp -71.03 -54.14 12.24 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.183 -0.462 . . . . 75.049999999999997 110.879 -179.978 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 13.4 t -51.69 -30.01 20.45 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.202 -0.453 . . . . 74.340000000000003 111.168 179.904 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 37.7 ttp -59.72 -41.95 91.99 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.205 -0.452 . . . . 74.25 110.842 179.975 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 3.5 mtt -79.84 -28.87 40.03 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.228 -0.442 . . . . 74.329999999999998 110.865 179.952 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.28 0 CA-C-N 116.273 -0.421 . . . . 75.400000000000006 111.111 179.908 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 5.0 mp . . . . . 0 C--O 1.231 0.106 0 CA-C-O 120.807 0.337 . . . . 73.310000000000002 111.117 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 20.4 ttt-85 -61.68 -28.23 69.25 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.188 -0.46 . . . . 74.030000000000001 110.865 -179.992 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 -68.19 -48.33 65.54 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.193 -0.458 . . . . 75.319999999999993 110.932 -179.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -74.04 -35.34 64.31 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.149 -0.478 . . . . 72.409999999999997 111.069 179.96 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 4.4 t80 -53.71 -47.78 70.2 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.256 -0.429 . . . . 75.129999999999995 110.863 -179.897 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 7.5 ptm180 -69.04 -25.95 64.73 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.131 -0.486 . . . . 74.019999999999996 110.875 -179.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 96.5 t -78.12 -27.4 14.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.194 -0.457 . . . . 75.230000000000004 111.131 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 21.9 m-85 -94.66 -26.14 16.45 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.134 -0.485 . . . . 73.340000000000003 110.888 -179.992 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 32.7 t0 -73.98 95.1 2.44 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.161 -0.472 . . . . 72.140000000000001 110.866 179.982 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 42.9 mmtt -78.68 -52.54 8.27 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.199 -0.455 . . . . 73.450000000000003 110.886 -180.0 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 52.1 p-10 -72.44 -9.15 58.17 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.211 -0.449 . . . . 72.239999999999995 110.838 179.917 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 59.79 28.37 65.59 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.709 -0.758 . . . . 73.299999999999997 112.487 -179.934 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 35.4 p-10 -81.77 -16.14 51.98 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.857 0.36 . . . . 63.240000000000002 110.881 -179.897 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 88.73 18.68 54.11 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.717 -0.754 . . . . 73.450000000000003 112.543 -179.952 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 23.6 m-85 -142.83 153.64 43.4 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.898 0.38 . . . . 72.129999999999995 110.918 -179.824 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 78.1 mt -119.25 127.04 75.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.089 -0.505 . . . . 72.420000000000002 111.133 179.954 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 6.4 p -112.44 -176.19 2.86 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.184 -0.462 . . . . 62.009999999999998 110.882 -179.946 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -74.31 -27.49 60.73 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.149 -0.478 . . . . 72.340000000000003 111.144 179.9 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -72.01 -47.68 50.1 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.21 -0.45 . . . . 71.340000000000003 111.09 179.951 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -67.78 -46.07 73.02 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.209 -0.45 . . . . 71.040000000000006 110.897 -179.922 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 21.2 tp -52.87 -39.56 62.74 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.109 -0.496 . . . . 75.530000000000001 110.936 179.986 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 63.0 ttp85 -55.46 -38.7 69.41 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.177 -0.465 . . . . 74.319999999999993 110.874 179.939 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 40.8 t60 -66.83 -34.37 77.67 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.171 -0.468 . . . . 72.150000000000006 110.862 -179.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 88.6 t -72.0 -51.18 32.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.21 -0.45 . . . . 74.200000000000003 111.132 179.955 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 1.3 mmt -60.61 -43.72 97.12 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.184 -0.462 . . . . 75.239999999999995 110.869 179.929 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 9.7 p -54.03 -27.26 31.02 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.235 -0.439 . . . . 74.25 111.137 -179.929 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.9 t30 -70.78 -31.68 68.54 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.223 -0.444 . . . . 74.099999999999994 110.885 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 8.2 mt -71.19 -26.21 62.86 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.201 -0.454 . . . . 63.020000000000003 110.89 179.967 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 100.89 32.62 5.29 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.752 -0.737 . . . . 71.299999999999997 112.5 179.902 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 13.8 mm-40 -113.78 119.98 39.2 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.908 0.385 . . . . 73.099999999999994 110.896 -179.88 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 7.7 tptm -68.89 97.95 0.89 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.125 -0.488 . . . . 74.200000000000003 110.902 179.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 16.4 mt -133.01 119.41 20.03 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.244 -0.434 . . . . 73.219999999999999 110.896 179.929 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 82.2 p -84.22 174.31 10.3 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.183 -0.462 . . . . 62.32 111.126 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -52.68 -42.93 65.22 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.23 -0.441 . . . . 70.510000000000005 110.884 179.881 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -62.29 -33.39 74.56 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.194 -0.457 . . . . 65.319999999999993 110.862 -179.882 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -70.84 -39.42 72.97 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.151 -0.477 . . . . 74.010000000000005 110.867 -179.91 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 21.9 t -65.25 -31.27 53.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.173 -0.467 . . . . 75.450000000000003 111.143 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 20.0 t0 -51.95 -46.11 64.62 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.133 -0.485 . . . . 73.430000000000007 110.905 179.919 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 13.3 tp10 -56.57 -29.6 62.21 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.198 -0.455 . . . . 73.400000000000006 110.878 -179.947 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 55.7 mtp -75.42 -59.51 2.72 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.171 -0.468 . . . . 74.109999999999999 110.913 179.957 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 35.9 mm -53.95 -35.69 28.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.216 -0.447 . . . . 75.510000000000005 111.119 179.948 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 1.6 tmt_? -63.33 -31.9 73.17 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.137 -0.483 . . . . 75.420000000000002 110.904 179.939 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -74.8 -52.39 11.58 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.203 -0.453 . . . . 64.25 110.887 -179.947 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -65.13 -34.44 78.4 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.19 -0.459 . . . . 75.439999999999998 111.081 179.957 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 49.3 t0 -68.38 86.73 0.29 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.247 -0.433 . . . . 74.049999999999997 110.853 179.981 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 61.1 mt -79.86 -46.21 22.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.228 -0.442 . . . . 74.430000000000007 111.17 179.982 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 21.2 p30 -72.8 -8.67 56.6 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.173 -0.467 . . . . 73.530000000000001 110.862 179.815 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 62.81 43.05 99.52 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.751 -0.737 . . . . 63.109999999999999 112.488 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 34.5 p-10 -88.3 -15.93 34.43 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.847 0.356 . . . . 71.329999999999998 110.907 -179.991 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 103.91 2.45 45.81 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.701 -0.761 . . . . 52.039999999999999 112.491 -179.957 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 4.1 tt0 -149.19 172.26 15.11 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.816 0.341 . . . . 72.439999999999998 110.894 -179.862 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 136' ' ' VAL . . . . . . . . . . . . . 86.5 t -107.84 111.91 37.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.192 -0.458 . . . . 74.430000000000007 111.135 179.939 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 43.6 p-10 -92.52 166.61 12.43 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.183 -0.462 . . . . 65.430000000000007 110.908 179.97 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 52.1 t80 -51.98 -46.79 64.98 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.169 -0.469 . . . . 74.439999999999998 110.949 -179.948 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -52.01 -43.77 63.82 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.116 -0.493 . . . . 75.530000000000001 110.847 -179.947 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 24.1 mt-10 -75.11 -31.86 61.24 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.204 -0.453 . . . . 62.509999999999998 110.877 -179.911 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 6.2 t80 -68.07 -35.35 78.06 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.114 -0.494 . . . . 75.409999999999997 110.902 -179.895 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 92.7 t -71.23 -42.14 74.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.161 -0.472 . . . . 75.0 111.15 179.932 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 18.4 tt0 -71.07 -28.55 64.43 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.156 -0.475 . . . . 73.109999999999999 110.89 -179.993 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 6.2 tpt -74.0 -55.24 6.38 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.211 -0.449 . . . . 75.329999999999998 110.911 179.927 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 11.9 ttm -66.09 -33.87 76.77 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.219 -0.446 . . . . 75.310000000000002 110.912 179.927 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 2.0 m . . . . . 0 C--N 1.33 -0.278 0 CA-C-N 116.235 -0.439 . . . . 72.239999999999995 111.177 -179.961 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' M' M ' 15' ' ' LYS . . . . . . . . . . . . . 7.4 mtmp? . . . . . 0 C--O 1.231 0.098 0 CA-C-O 120.787 0.327 . . . . 73.310000000000002 110.881 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' M' M ' 16' ' ' TRP . . . . . . . . . . . . . 19.2 m95 -51.99 -38.95 58.53 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.184 -0.462 . . . . 73.319999999999993 110.978 179.917 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' M' M ' 17' ' ' GLU . . . . . . . . . . . . . 30.9 tp10 -56.17 -32.21 64.12 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.205 -0.452 . . . . 75.140000000000001 110.833 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' M' M ' 18' ' ' LYS . . . . . . . . . . . . . 6.4 ttpm? -63.36 -29.22 70.56 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.178 -0.464 . . . . 74.540000000000006 110.923 179.986 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' M' M ' 19' ' ' ILE . . . . . . . . . . . . . 28.8 mt -86.48 -25.13 6.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.192 -0.458 . . . . 72.409999999999997 111.166 179.86 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' M' M ' 20' ' ' ARG . . . . . . . . . . . . . 22.6 ttp180 . . . . . 0 C--N 1.33 -0.261 0 CA-C-N 116.17 -0.468 . . . . 75.150000000000006 110.863 179.984 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' M' M ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.146 0 CA-C-O 120.775 0.321 . . . . 74.510000000000005 110.889 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' M' M ' 31' ' ' LEU . . . . . . . . . . . . . 13.7 tp -137.25 -51.39 0.65 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.196 -0.456 . . . . 73.319999999999993 110.911 179.924 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' M' M ' 32' ' ' LYS . . . . . . . . . . . . . 3.0 ptpp? -49.55 -39.14 33.74 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.219 -0.446 . . . . 72.540000000000006 110.901 179.81 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' M' M ' 33' ' ' HIS . . . . . . . . . . . . . 10.7 t-160 -50.09 -41.26 47.92 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.227 -0.442 . . . . 73.129999999999995 110.861 179.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' M' M ' 34' ' ' ILE . . . . . . . . . . . . . 65.0 mt -50.37 -39.32 16.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.19 -0.459 . . . . 72.540000000000006 111.148 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' M' M ' 35' ' ' VAL . . . . . . . . . . . . . 61.5 t -49.16 -40.28 13.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.192 -0.458 . . . . 73.549999999999997 111.121 179.824 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' M' M ' 36' ' ' TRP . . . . . . . . . . . . . 21.7 m0 -58.93 -39.52 81.83 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.122 -0.49 . . . . 74.420000000000002 110.927 179.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' M' M ' 37' ' ' ALA . . . . . . . . . . . . . . . -64.13 -18.61 64.59 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.218 -0.446 . . . . 64.200000000000003 111.117 179.869 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' M' M ' 38' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -72.18 -17.98 61.9 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.237 -0.438 . . . . 74.150000000000006 110.872 -179.8 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' M' M ' 39' ' ' ARG . . . . . . . . . . . . . 4.6 tpt85 -60.75 -25.47 66.51 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.116 -0.493 . . . . 71.519999999999996 110.896 -179.914 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' M' M ' 40' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 -78.04 -47.99 17.12 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.131 -0.486 . . . . 71.329999999999998 110.874 -179.9 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' M' M ' 41' ' ' LEU . . . . . . . . . . . . . 17.3 mt . . . . . 0 C--N 1.329 -0.309 0 CA-C-N 116.163 -0.471 . . . . 74.109999999999999 110.93 179.98 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 19.4 tt0 . . . . . 0 C--O 1.231 0.113 0 CA-C-O 120.772 0.32 . . . . 72.310000000000002 110.936 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 61.7 mt -68.78 -37.3 77.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.192 -0.458 . . . . 63.329999999999998 111.115 179.991 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -52.33 -49.85 63.45 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.166 -0.47 . . . . 64.120000000000005 111.082 179.852 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 17.0 mm-40 -54.92 -39.91 69.3 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.222 -0.445 . . . . 75.219999999999999 110.903 -179.916 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 31.4 m-85 -72.68 -41.2 65.59 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.148 -0.478 . . . . 74.140000000000001 110.852 -179.921 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 18.4 ttpp -54.81 -41.69 70.94 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.167 -0.47 . . . . 71.209999999999994 110.88 -179.99 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 8.4 tt0 -59.11 -36.12 74.63 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.228 -0.442 . . . . 73.400000000000006 110.884 179.948 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -67.91 -49.69 60.44 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.147 -0.478 . . . . 64.120000000000005 111.089 179.957 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 57.8 t80 -52.15 -49.52 63.59 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.226 -0.443 . . . . 74.439999999999998 110.913 -179.904 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 12.9 t -57.14 -30.39 64.39 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.151 -0.477 . . . . 70.230000000000004 110.893 -179.81 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 15.7 tp -66.06 -42.2 89.78 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.068 -0.514 . . . . 75.150000000000006 110.885 179.984 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 67.6 m-85 -78.02 -24.92 47.72 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.222 -0.445 . . . . 74.340000000000003 110.866 179.94 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 14.3 t0 -79.14 98.61 6.63 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.178 -0.464 . . . . 75.430000000000007 110.866 179.975 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 9.2 ttmm -66.49 -50.28 63.79 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.201 -0.454 . . . . 63.32 110.895 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 18.5 p-10 -81.46 -10.09 59.57 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.219 -0.446 . . . . 72.010000000000005 110.831 179.908 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 52.04 55.64 20.38 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.73 -0.748 . . . . 41.409999999999997 112.508 -179.889 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 29.2 p-10 -111.56 17.74 19.73 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.798 0.332 . . . . 72.329999999999998 110.849 -179.968 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 71.68 18.25 77.17 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.753 -0.737 . . . . 63.210000000000001 112.529 -179.907 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 22.3 p -145.46 156.53 43.8 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.714 0.292 . . . . 73.510000000000005 111.155 -179.85 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 28.8 mt -130.27 125.47 59.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.233 -0.44 . . . . 74.030000000000001 111.193 179.924 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 80.9 p -110.53 177.14 4.78 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.206 -0.452 . . . . 70.109999999999999 111.168 179.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 49.5 p -63.54 -25.47 68.26 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.22 -0.445 . . . . 74.430000000000007 111.115 -179.962 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 2.3 tppt? -79.96 -50.17 10.82 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.174 -0.466 . . . . 75.150000000000006 110.868 179.94 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 -67.89 -36.97 81.15 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.207 -0.451 . . . . 75.530000000000001 110.867 179.996 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.1 tt -73.83 -53.58 9.92 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.157 -0.474 . . . . 70.310000000000002 110.957 -179.973 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -51.92 -28.4 24.3 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.743 -0.741 . . . . 61.140000000000001 112.524 179.83 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 97.6 m -63.18 -58.99 5.37 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.883 0.373 . . . . 73.0 111.172 -179.866 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 51.6 t -57.72 -34.57 48.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.173 -0.467 . . . . 72.310000000000002 111.141 179.891 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 6.3 mmm -59.62 -49.01 79.41 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.158 -0.474 . . . . 73.329999999999998 110.874 179.968 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 29.7 ttp180 -57.17 -42.65 81.52 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.236 -0.438 . . . . 75.420000000000002 110.872 -179.945 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.6 t -57.91 -25.28 60.64 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.202 -0.454 . . . . 73.150000000000006 110.883 -179.814 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 83.3 mt -94.41 -10.39 32.64 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.084 -0.507 . . . . 70.439999999999998 110.876 -179.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 101.54 -6.63 55.4 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.76 -0.733 . . . . 75.200000000000003 112.468 179.93 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 15.8 tp60 -87.39 102.34 14.44 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.833 0.349 . . . . 75.099999999999994 110.9 -179.853 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 6.1 t-20 -109.85 76.75 0.98 Allowed Pre-proline 0 C--N 1.33 -0.279 0 CA-C-O 121.574 0.702 . . . . 73.5 110.887 -179.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.79 168.0 22.86 Favored 'Trans proline' 0 C--O 1.232 0.187 0 C-N-CA 122.709 2.273 . . . . 72.420000000000002 112.351 179.937 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 79.0 p -84.68 161.78 19.94 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.237 -0.438 . . . . 64.439999999999998 111.118 -179.949 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 94.1 mt-10 -52.41 -38.9 60.14 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.17 -0.468 . . . . 74.430000000000007 110.862 179.983 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.32 -39.28 65.39 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.183 -0.462 . . . . 72.420000000000002 111.051 179.957 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -62.09 -47.55 84.13 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.232 -0.44 . . . . 73.25 110.906 -179.923 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 22.0 mt -55.43 -47.48 75.91 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.159 -0.473 . . . . 71.310000000000002 110.894 -179.984 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 37.1 tp60 -71.86 -28.1 63.32 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.216 -0.447 . . . . 73.310000000000002 110.897 179.938 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -56.21 -49.77 73.14 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.218 -0.446 . . . . 74.400000000000006 110.888 179.904 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 6.0 ptp -69.85 -36.28 75.41 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.191 -0.459 . . . . 75.230000000000004 110.894 -179.986 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 87.3 mt -63.78 -41.35 92.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.249 -0.432 . . . . 73.310000000000002 111.153 179.922 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 34.5 m-20 -70.38 -31.7 69.05 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.18 -0.464 . . . . 73.230000000000004 110.907 179.935 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -71.62 -25.09 62.01 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.142 -0.481 . . . . 75.030000000000001 110.851 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 29.1 m -106.65 7.2 9.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.196 -0.456 . . . . 52.32 111.119 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -82.62 99.77 9.77 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.192 -0.458 . . . . 73.209999999999994 110.843 179.961 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.4 -33.85 17.76 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.148 -0.478 . . . . 72.200000000000003 111.147 179.932 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 2.6 p-10 -92.52 -0.57 57.32 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.199 -0.455 . . . . 75.230000000000004 110.869 179.945 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 50.85 60.94 6.5 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.744 -0.741 . . . . 72.109999999999999 112.517 -179.899 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 50.9 p-10 -114.55 -15.78 11.97 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.915 0.388 . . . . 61.240000000000002 110.901 -179.873 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 95.43 15.71 42.87 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.726 -0.75 . . . . 62.340000000000003 112.503 179.963 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 22.5 p -152.68 175.45 12.81 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.795 0.331 . . . . 71.239999999999995 111.157 -179.922 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 27.0 mt -106.83 111.57 36.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.213 -0.449 . . . . 72.109999999999999 111.13 179.912 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -77.93 -172.78 2.83 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.158 -0.474 . . . . 72.019999999999996 110.856 179.89 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.528 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 2.4 t80 -64.93 -57.94 14.38 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.604 0.716 . . . . 73.340000000000003 110.9 -179.895 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . 0.528 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 53.8 Cg_endo -69.78 -28.74 24.76 Favored 'Trans proline' 0 C--N 1.341 0.159 0 C-N-CA 122.677 2.251 . . . . 74.450000000000003 112.353 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 18.2 mt-10 -60.97 -39.73 90.72 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.188 -0.46 . . . . 72.150000000000006 110.875 -179.984 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 20.1 t80 -74.3 -36.23 63.72 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.094 -0.503 . . . . 75.329999999999998 110.848 -179.864 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 27.7 tp -69.53 -53.82 17.15 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.191 -0.459 . . . . 74.530000000000001 110.913 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 14.7 t -53.08 -27.95 22.74 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.193 -0.458 . . . . 61.229999999999997 111.134 179.934 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 42.6 ttp -64.4 -49.9 69.72 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.27 -0.423 . . . . 74.450000000000003 110.856 179.914 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 1.2 mtt -53.33 -44.15 68.24 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.244 -0.435 . . . . 63.229999999999997 110.849 179.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.301 0 CA-C-N 116.229 -0.441 . . . . 61.329999999999998 111.109 179.933 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 62.1 mt . . . . . 0 C--O 1.231 0.123 0 CA-C-O 120.784 0.326 . . . . 75.219999999999999 111.161 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 44.8 ttp85 -68.82 -52.25 32.07 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.164 -0.471 . . . . 74.109999999999999 110.845 179.977 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 16.0 tp10 -54.54 -53.48 53.9 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.24 -0.436 . . . . 74.25 110.908 -179.937 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -53.36 -50.74 64.43 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.127 -0.488 . . . . 74.340000000000003 111.12 179.911 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 5.9 t80 -52.12 -51.28 58.84 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.22 -0.445 . . . . 74.329999999999998 110.899 -179.957 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 60.0 ttt-85 -59.93 -45.05 93.84 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.199 -0.455 . . . . 65.140000000000001 110.873 -179.93 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 91.6 t -53.94 -45.47 63.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.211 -0.45 . . . . 72.319999999999993 111.172 179.954 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 10.7 m-85 -76.39 -26.35 55.49 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.167 -0.47 . . . . 73.540000000000006 110.873 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 14.1 t0 -68.11 96.77 0.65 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.159 -0.473 . . . . 72.140000000000001 110.889 179.958 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 17.3 mmtt -75.16 -53.2 9.24 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.164 -0.471 . . . . 64.099999999999994 110.923 179.973 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 52.9 p30 -77.09 -9.07 58.49 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.215 -0.448 . . . . 73.349999999999994 110.808 179.919 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 59.6 26.51 62.42 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.74 -0.743 . . . . 71.5 112.459 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 37.8 p-10 -81.9 -16.12 51.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.878 0.37 . . . . 73.040000000000006 110.919 -179.905 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 90.08 18.76 49.21 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.773 -0.727 . . . . 60.119999999999997 112.483 179.927 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 15.0 m-85 -140.41 132.38 27.76 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.858 0.361 . . . . 72.129999999999995 110.917 -179.779 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 62.2 mt -101.2 135.04 39.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.138 -0.483 . . . . 72.040000000000006 111.151 179.902 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 89.5 p -117.1 -177.97 3.33 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.167 -0.469 . . . . 61.130000000000003 110.843 -179.881 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -70.32 -35.51 73.69 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.139 -0.482 . . . . 74.299999999999997 111.058 179.922 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -71.9 -35.28 69.66 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.246 -0.433 . . . . 63.530000000000001 111.104 179.931 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -76.88 -46.64 23.78 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.226 -0.443 . . . . 74.510000000000005 110.888 -179.909 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 19.0 tp -52.96 -48.01 67.72 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.175 -0.466 . . . . 74.409999999999997 110.893 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 59.3 ttp85 -51.99 -40.04 60.31 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.199 -0.455 . . . . 72.129999999999995 110.858 179.975 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 13.5 t60 -55.85 -34.4 65.39 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.187 -0.46 . . . . 70.430000000000007 110.838 179.994 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 54.5 t -72.59 -52.03 25.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.235 -0.439 . . . . 75.209999999999994 111.122 -179.993 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 10.3 mmt -53.99 -28.12 35.91 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.153 -0.476 . . . . 72.409999999999997 110.874 179.908 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 4.0 m -66.9 -37.09 83.73 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.198 -0.455 . . . . 64.120000000000005 111.159 -179.907 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 43.0 t-20 -73.48 -26.12 60.76 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.212 -0.449 . . . . 73.430000000000007 110.904 179.975 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -70.69 -25.89 63.18 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.165 -0.47 . . . . 72.209999999999994 110.934 179.96 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 100.97 19.85 15.89 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.757 -0.735 . . . . 53.219999999999999 112.5 179.873 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -111.34 115.68 29.71 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.931 0.396 . . . . 74.400000000000006 110.892 -179.896 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 40.3 pttt -70.65 121.53 18.08 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.123 -0.489 . . . . 71.510000000000005 110.935 179.923 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 11.3 mt -143.33 161.0 39.49 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.235 -0.439 . . . . 74.329999999999998 110.935 179.947 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 67.9 p -118.59 174.33 6.33 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.205 -0.452 . . . . 73.420000000000002 111.089 179.993 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 47.8 m-20 -52.04 -48.35 64.63 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.182 -0.463 . . . . 64.430000000000007 110.865 179.9 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -60.67 -33.44 72.83 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.166 -0.47 . . . . 75.219999999999999 110.945 -179.929 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -68.97 -44.81 72.17 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.133 -0.485 . . . . 75.109999999999999 110.904 -179.979 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 63.3 t -58.04 -33.32 46.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.174 -0.466 . . . . 71.230000000000004 111.106 179.963 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -51.97 -43.76 63.7 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.229 -0.441 . . . . 64.310000000000002 110.863 179.934 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 22.9 tp10 -56.33 -31.52 63.8 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.202 -0.454 . . . . 75.420000000000002 110.916 -179.928 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 80.0 mtp -76.03 -59.5 2.73 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.16 -0.473 . . . . 74.209999999999994 110.891 179.938 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 34.8 mm -53.99 -35.74 29.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.198 -0.455 . . . . 73.430000000000007 111.097 179.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 9.6 tpt180 -65.43 -31.76 73.02 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.187 -0.46 . . . . 75.129999999999995 110.842 179.991 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -71.97 -49.71 35.0 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.202 -0.454 . . . . 72.209999999999994 110.852 -179.908 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -70.39 -33.66 71.66 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.208 -0.451 . . . . 61.219999999999999 111.087 179.936 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 50.7 t0 -68.41 86.63 0.29 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.21 -0.45 . . . . 71.299999999999997 110.835 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 59.1 mt -79.98 -45.33 22.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.18 -0.464 . . . . 75.349999999999994 111.148 179.962 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 23.1 p30 -72.69 -8.82 57.24 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.168 -0.469 . . . . 61.020000000000003 110.833 179.866 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 62.8 43.76 98.47 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.725 -0.75 . . . . 34.229999999999997 112.481 -179.925 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 32.5 p-10 -89.33 -16.05 31.99 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.868 0.365 . . . . 64.319999999999993 110.882 -179.961 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 102.66 3.37 49.74 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.724 -0.75 . . . . 63.340000000000003 112.478 -179.964 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 3.8 tt0 -149.26 172.22 15.23 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.816 0.341 . . . . 74.140000000000001 110.923 -179.87 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 136' ' ' VAL . . . . . . . . . . . . . 98.9 t -113.18 114.87 48.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.248 -0.433 . . . . 73.420000000000002 111.192 179.94 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 41.9 p-10 -93.28 167.87 11.46 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.174 -0.466 . . . . 74.109999999999999 110.928 -179.975 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 14.1 t80 -51.96 -43.65 63.61 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.218 -0.446 . . . . 72.519999999999996 110.971 -179.931 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -55.74 -55.14 35.79 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.148 -0.478 . . . . 72.010000000000005 110.881 179.96 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 88.8 mt-10 -62.08 -45.42 93.58 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.172 -0.467 . . . . 65.319999999999993 110.9 -179.941 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 69.4 t80 -54.88 -54.94 36.03 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.129 -0.487 . . . . 74.129999999999995 110.903 -179.914 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 96.8 t -53.86 -43.35 56.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.13 -0.486 . . . . 74.239999999999995 111.172 179.91 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -64.23 -58.42 6.62 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.155 -0.475 . . . . 71.25 110.934 179.978 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 11.3 tpt -57.5 -24.83 58.17 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.235 -0.439 . . . . 74.219999999999999 110.909 179.927 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -86.75 -24.14 25.21 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.2 -0.455 . . . . 73.439999999999998 110.898 179.932 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 97.3 m . . . . . 0 C--N 1.33 -0.262 0 CA-C-N 116.234 -0.439 . . . . 74.400000000000006 111.119 -179.934 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' M' M ' 15' ' ' LYS . . . . . . . . . . . . . 7.2 mttp . . . . . 0 C--O 1.232 0.135 0 CA-C-O 120.768 0.318 . . . . 74.420000000000002 110.895 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' M' M ' 16' ' ' TRP . . . . . . . . . . . . . 67.2 m95 -52.82 -41.46 64.23 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.216 -0.447 . . . . 74.510000000000005 110.893 179.909 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' M' M ' 17' ' ' GLU . . . . . . . . . . . . . 15.4 tm-20 -57.4 -30.2 64.74 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.241 -0.436 . . . . 72.310000000000002 110.893 -179.929 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' M' M ' 18' ' ' LYS . . . . . . . . . . . . . 15.5 tttp -62.91 -28.03 69.78 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.176 -0.465 . . . . 75.209999999999994 110.875 179.946 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' M' M ' 19' ' ' ILE . . . . . . . . . . . . . 22.7 mt -98.66 -23.83 4.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.267 -0.424 . . . . 74.329999999999998 111.156 179.868 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' M' M ' 20' ' ' ARG . . . . . . . . . . . . . 30.6 ttt-85 . . . . . 0 C--N 1.329 -0.285 0 CA-C-N 116.185 -0.461 . . . . 75.409999999999997 110.836 -179.971 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' M' M ' 30' ' ' LYS . . . . . . . . . . . . . 2.1 pttp . . . . . 0 C--O 1.232 0.135 0 CA-C-O 120.776 0.322 . . . . 75.030000000000001 110.857 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' M' M ' 31' ' ' LEU . . . . . . . . . . . . . 7.2 tp -124.33 -48.78 1.82 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.228 -0.442 . . . . 71.25 110.918 179.935 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' M' M ' 32' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -47.21 -40.15 15.62 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.212 -0.449 . . . . 71.209999999999994 110.937 179.809 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' M' M ' 33' ' ' HIS . . . . . . . . . . . . . 79.9 t60 -48.12 -46.35 34.04 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.148 -0.478 . . . . 75.200000000000003 110.865 179.913 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' M' M ' 34' ' ' ILE . . . . . . . . . . . . . 3.3 mt -51.77 -38.57 22.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.214 -0.448 . . . . 75.430000000000007 111.096 179.996 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' M' M ' 35' ' ' VAL . . . . . . . . . . . . . 48.5 t -50.1 -38.9 15.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.18 -0.464 . . . . 60.509999999999998 111.107 179.886 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' M' M ' 36' ' ' TRP . . . . . . . . . . . . . 26.6 m0 -59.29 -39.03 81.67 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.188 -0.46 . . . . 73.209999999999994 110.914 179.954 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' M' M ' 37' ' ' ALA . . . . . . . . . . . . . . . -63.94 -18.39 64.2 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.225 -0.443 . . . . 70.140000000000001 111.095 179.911 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' M' M ' 38' ' ' SER . . . . . . . . . . . . . 2.5 m -71.07 -17.94 62.58 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.243 -0.435 . . . . 73.230000000000004 110.857 -179.803 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' M' M ' 39' ' ' ARG . . . . . . . . . . . . . 14.9 mmm180 -52.07 -29.96 23.71 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.151 -0.477 . . . . 73.409999999999997 110.849 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' M' M ' 40' ' ' GLU . . . . . . . . . . . . . 9.4 tt0 -92.37 -40.71 10.74 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.21 -0.45 . . . . 64.439999999999998 110.915 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' M' M ' 41' ' ' LEU . . . . . . . . . . . . . 5.0 mt . . . . . 0 C--N 1.328 -0.329 0 CA-C-N 116.162 -0.472 . . . . 72.430000000000007 110.931 179.991 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 1.6 tp-100 . . . . . 0 C--O 1.232 0.138 0 CA-C-O 120.734 0.302 . . . . 72.299999999999997 110.904 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 62.0 mt -67.04 -37.14 78.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.212 -0.449 . . . . 74.109999999999999 111.124 179.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -51.95 -49.9 62.27 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.191 -0.459 . . . . 63.539999999999999 111.098 179.815 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 25.3 mm-40 -54.87 -52.24 63.45 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.179 -0.464 . . . . 74.420000000000002 110.931 -179.966 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 66.0 m-85 -60.04 -44.17 94.83 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.123 -0.489 . . . . 73.430000000000007 110.933 -179.953 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 38.0 ttmt -51.98 -33.5 38.26 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.088 -0.505 . . . . 75.319999999999993 110.866 -179.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -68.74 -36.65 78.66 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.234 -0.439 . . . . 75.430000000000007 110.904 179.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -66.52 -52.28 47.52 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.14 -0.482 . . . . 74.140000000000001 111.076 179.931 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 42.4 t80 -52.6 -47.44 66.94 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.19 -0.459 . . . . 74.439999999999998 110.859 -179.898 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.6 m -59.48 -28.98 67.5 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.156 -0.475 . . . . 63.299999999999997 110.885 -179.793 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 15.3 tp -68.59 -47.54 66.48 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.111 -0.495 . . . . 75.400000000000006 110.897 -179.995 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 62.1 m-85 -71.67 -26.09 62.39 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.178 -0.465 . . . . 70.030000000000001 110.89 179.928 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 18.6 t0 -86.33 98.47 10.99 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.154 -0.475 . . . . 71.420000000000002 110.845 -179.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 39.6 mtpt -71.86 -53.12 14.21 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.216 -0.447 . . . . 75.030000000000001 110.862 -179.977 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 26.3 p-10 -73.5 -10.11 59.39 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.244 -0.435 . . . . 73.439999999999998 110.802 179.912 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 52.03 46.45 55.88 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.792 -0.718 . . . . 52.450000000000003 112.451 -179.946 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 26.7 p-10 -88.46 -15.73 34.62 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.891 0.377 . . . . 71.5 110.906 179.993 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 105.32 -11.73 47.65 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.696 -0.764 . . . . 65.030000000000001 112.508 -179.902 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 51.6 p -131.31 130.71 43.09 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.755 0.312 . . . . 72.230000000000004 111.157 -179.886 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 29.8 mt -90.72 135.82 25.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.206 -0.452 . . . . 65.340000000000003 111.138 179.898 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 15.0 p -115.97 -179.37 3.64 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.195 -0.457 . . . . 61.039999999999999 111.176 179.936 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 8.2 p -68.69 -33.02 73.25 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.227 -0.442 . . . . 73.25 111.167 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 14.8 ptpt -69.6 -41.42 75.75 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.194 -0.457 . . . . 75.319999999999993 110.889 179.878 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 62.1 mt-10 -75.9 -35.4 59.83 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.22 -0.445 . . . . 75.340000000000003 110.924 179.968 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.1 tt -74.31 -53.78 9.01 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.136 -0.484 . . . . 75.549999999999997 110.904 -179.962 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -52.1 -43.28 56.08 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.801 -0.714 . . . . 65.409999999999997 112.488 179.904 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 96.0 m -56.97 -55.07 39.45 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.816 0.341 . . . . 75.299999999999997 111.146 -179.896 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 100.0 t -51.67 -50.22 31.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.21 -0.45 . . . . 72.400000000000006 111.096 179.937 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 7.5 mtp -51.97 -39.07 58.77 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.16 -0.473 . . . . 75.400000000000006 110.905 179.932 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 30.1 ttt85 -54.11 -40.15 67.04 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.179 -0.464 . . . . 73.030000000000001 110.837 -179.9 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 3.8 t -76.8 -28.39 55.59 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.179 -0.464 . . . . 71.5 110.904 -179.809 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 58.6 mt -76.98 -21.49 54.63 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.127 -0.488 . . . . 74.540000000000006 110.909 179.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 101.45 31.11 5.65 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.753 -0.737 . . . . 73.319999999999993 112.476 179.858 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 2.2 tp-100 -116.96 140.32 49.61 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.842 0.353 . . . . 75.209999999999994 110.856 -179.85 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 29.8 t30 -109.87 76.8 0.99 Allowed Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.63 0.729 . . . . 72.329999999999998 110.913 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.75 140.0 41.64 Favored 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.71 2.274 . . . . 64.349999999999994 112.311 179.951 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 19.9 p -97.29 158.35 15.5 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.2 -0.454 . . . . 74.540000000000006 111.157 -179.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -51.94 -43.41 63.46 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.225 -0.443 . . . . 75.420000000000002 110.914 179.966 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.36 -32.93 64.81 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.18 -0.463 . . . . 65.319999999999993 111.088 179.937 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 11.0 tt0 -67.57 -50.77 56.85 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.194 -0.457 . . . . 75.120000000000005 110.89 -179.936 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 45.9 mt -55.05 -51.85 65.02 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.172 -0.467 . . . . 70.200000000000003 110.951 179.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 29.8 tp60 -57.24 -29.07 63.47 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.148 -0.478 . . . . 73.219999999999999 110.94 179.89 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -72.17 -37.6 69.3 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.208 -0.451 . . . . 72.099999999999994 110.881 179.964 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 5.7 mtp -63.7 -57.89 8.59 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.172 -0.467 . . . . 74.099999999999994 110.858 179.985 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 62.4 mt -54.89 -45.27 75.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.243 -0.435 . . . . 74.409999999999997 111.143 179.972 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 76.8 m-20 -66.32 -33.84 76.63 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.183 -0.462 . . . . 73.209999999999994 110.884 179.921 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -63.12 -30.56 71.68 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.212 -0.449 . . . . 75.010000000000005 110.861 -179.965 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 4.8 m -111.12 18.98 7.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.162 -0.472 . . . . 73.150000000000006 111.095 -179.987 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 31.5 t0 -89.99 93.06 9.25 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.205 -0.452 . . . . 65.439999999999998 110.889 179.893 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.16 -33.71 18.1 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.249 -0.432 . . . . 75.310000000000002 111.079 179.962 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 14.7 p30 -91.35 -0.15 57.61 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.226 -0.443 . . . . 65.420000000000002 110.868 179.962 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 52.35 59.54 8.86 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.726 -0.75 . . . . 70.409999999999997 112.496 -179.899 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 51.5 p-10 -114.48 -15.73 12.01 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.833 0.349 . . . . 70.230000000000004 110.919 -179.926 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 89.77 18.46 51.32 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.715 -0.755 . . . . 74.129999999999995 112.505 179.966 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 22.5 p -152.65 159.37 43.2 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.788 0.328 . . . . 54.32 111.167 -179.914 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 25.1 mt -91.94 109.48 21.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.215 -0.448 . . . . 75.400000000000006 111.137 179.907 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.4 t0 -73.82 -176.42 2.43 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.152 -0.476 . . . . 70.510000000000005 110.867 179.875 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.522 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 2.5 t80 -62.85 -58.32 17.19 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-O 121.652 0.739 . . . . 74.120000000000005 110.914 -179.887 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . 0.522 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 53.7 Cg_endo -69.81 -30.02 22.7 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.697 2.264 . . . . 74.540000000000006 112.344 179.982 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 -57.24 -41.47 79.6 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.205 -0.452 . . . . 73.409999999999997 110.918 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 24.2 t80 -74.14 -36.1 64.12 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.106 -0.497 . . . . 75.400000000000006 110.886 -179.971 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 28.9 tp -65.48 -53.65 39.5 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.155 -0.475 . . . . 75.439999999999998 110.887 -179.937 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 11.2 t -54.02 -26.69 27.61 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.247 -0.433 . . . . 74.439999999999998 111.129 179.967 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 42.9 ttp -70.67 -35.46 72.85 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.208 -0.451 . . . . 73.549999999999997 110.89 179.937 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 11.1 mtp -77.69 -33.72 53.14 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.213 -0.449 . . . . 74.430000000000007 110.888 179.938 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.284 0 CA-C-N 116.227 -0.442 . . . . 54.310000000000002 111.059 179.958 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 54.8 mt . . . . . 0 N--CA 1.458 -0.068 0 CA-C-O 120.835 0.35 . . . . 72.329999999999998 111.133 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.16 -30.3 26.15 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.104 -0.498 . . . . 74.150000000000006 110.882 179.988 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 11.1 tt0 -76.41 -56.95 4.16 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.211 -0.449 . . . . 74.299999999999997 110.866 -179.953 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -54.82 -43.23 72.78 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.141 -0.482 . . . . 73.5 111.089 179.962 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 8.8 t80 -52.02 -51.19 59.01 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.226 -0.443 . . . . 75.209999999999994 110.892 -179.953 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 50.3 ttt-85 -58.84 -44.89 91.07 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.124 -0.489 . . . . 73.340000000000003 110.902 -179.939 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 57.6 t -54.67 -49.36 68.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.178 -0.465 . . . . 73.129999999999995 111.185 179.938 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 8.9 m-85 -70.92 -32.36 69.26 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.149 -0.478 . . . . 72.150000000000006 110.889 179.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 16.6 t0 -61.71 96.72 0.07 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.175 -0.466 . . . . 75.209999999999994 110.822 179.983 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 58.2 mmtt -76.24 -53.17 8.64 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.175 -0.466 . . . . 64.329999999999998 110.876 179.993 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 56.0 p-10 -76.02 -9.17 58.4 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.216 -0.447 . . . . 72.439999999999998 110.872 179.868 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 59.64 26.87 63.03 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.733 -0.746 . . . . 44.509999999999998 112.45 -179.96 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 42.4 p-10 -81.77 -16.17 51.87 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.863 0.363 . . . . 75.099999999999994 110.908 -179.956 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 91.89 18.75 42.63 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.748 -0.739 . . . . 73.420000000000002 112.494 -179.998 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 6.2 m-85 -136.42 159.32 42.12 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.855 0.36 . . . . 73.439999999999998 110.907 -179.802 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 62.8 mt -122.4 123.95 69.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.143 -0.48 . . . . 74.5 111.127 179.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 63.2 p -107.17 -172.58 2.11 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.175 -0.466 . . . . 54.119999999999997 110.835 -179.913 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -73.96 -36.6 64.6 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.112 -0.494 . . . . 73.420000000000002 111.056 179.935 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -72.0 -31.37 66.16 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.228 -0.442 . . . . 73.510000000000005 111.11 179.983 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -74.9 -48.69 23.39 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.163 -0.471 . . . . 71.530000000000001 110.882 -179.924 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 22.1 tp -54.02 -47.89 71.05 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.162 -0.472 . . . . 74.219999999999999 110.937 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 42.2 ttp85 -52.37 -44.53 65.33 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.182 -0.463 . . . . 71.450000000000003 110.904 179.911 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 11.1 t60 -58.45 -34.53 70.94 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.202 -0.453 . . . . 74.030000000000001 110.832 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 92.7 t -67.04 -52.2 46.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.201 -0.454 . . . . 73.150000000000006 111.175 179.948 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 4.2 mmt -64.2 -46.07 85.5 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.139 -0.482 . . . . 73.200000000000003 110.85 179.905 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 41.8 p -51.88 -37.16 51.18 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.24 -0.436 . . . . 64.310000000000002 111.174 -179.933 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 43.8 t30 -57.86 -33.7 68.96 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.211 -0.45 . . . . 72.340000000000003 110.916 179.953 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 15.3 mt -70.7 -23.9 62.55 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.151 -0.477 . . . . 72.400000000000006 110.908 179.943 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 101.06 32.93 5.13 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.714 -0.755 . . . . 74.319999999999993 112.428 179.883 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -110.07 116.27 31.26 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.92 0.391 . . . . 74.239999999999995 110.898 -179.918 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 29.3 tttm -60.73 120.29 9.79 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.153 -0.476 . . . . 73.540000000000006 110.931 179.96 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 19.8 mt -145.88 155.42 42.87 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.246 -0.434 . . . . 71.120000000000005 110.897 179.92 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 41.0 p -118.73 169.03 10.18 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.168 -0.469 . . . . 72.420000000000002 111.177 179.943 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 41.2 m-20 -53.07 -46.08 68.43 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.268 -0.424 . . . . 72.420000000000002 110.897 179.887 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 17.9 tt0 -63.54 -34.23 77.35 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.188 -0.46 . . . . 72.439999999999998 110.867 -179.921 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -67.23 -32.65 73.84 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.186 -0.461 . . . . 72.430000000000007 110.871 -179.902 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 92.8 t -69.48 -32.67 53.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.154 -0.475 . . . . 74.310000000000002 111.137 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 10.8 t0 -51.95 -46.92 64.92 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.18 -0.464 . . . . 71.299999999999997 110.878 179.948 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -55.74 -29.3 59.32 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.131 -0.486 . . . . 72.5 110.873 -179.898 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 1.2 mtp -75.37 -59.74 2.61 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.155 -0.475 . . . . 65.209999999999994 110.866 -179.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 35.5 mm -54.13 -35.61 29.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.215 -0.448 . . . . 75.329999999999998 111.11 179.977 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 51.2 ttt180 -63.03 -31.78 72.99 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.174 -0.466 . . . . 74.510000000000005 110.893 179.957 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 9.7 tt0 -75.33 -52.48 10.71 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.183 -0.462 . . . . 74.310000000000002 110.883 -179.893 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -64.92 -33.87 77.07 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.117 -0.492 . . . . 64.140000000000001 111.071 179.959 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 49.5 t0 -68.73 86.31 0.32 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.238 -0.437 . . . . 73.329999999999998 110.882 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 4.0 mt -79.91 -45.72 22.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.229 -0.442 . . . . 75.140000000000001 111.128 -179.952 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 22.0 p30 -72.77 -8.8 57.18 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.184 -0.462 . . . . 73.409999999999997 110.88 179.823 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 62.86 44.41 97.48 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.73 -0.748 . . . . 55.539999999999999 112.518 -179.891 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 31.8 p-10 -90.44 -15.95 29.92 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.841 0.353 . . . . 75.239999999999995 110.882 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 101.97 3.77 51.62 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.726 -0.75 . . . . 75.209999999999994 112.518 -179.906 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 4.4 tt0 -149.29 172.31 15.09 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.873 0.368 . . . . 75.409999999999997 110.91 -179.857 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 136' ' ' VAL . . . . . . . . . . . . . 66.9 t -114.78 111.09 34.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.187 -0.461 . . . . 62.130000000000003 111.166 179.964 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 45.4 p-10 -93.67 171.66 8.75 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.17 -0.468 . . . . 71.530000000000001 110.915 -179.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 86.9 t80 -56.18 -46.83 79.21 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.232 -0.44 . . . . 72.420000000000002 110.901 -179.901 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 22.1 tt0 -52.11 -44.56 64.51 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.097 -0.501 . . . . 74.349999999999994 110.914 -179.981 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 94.9 mt-10 -73.94 -40.26 63.2 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.166 -0.47 . . . . 71.549999999999997 110.87 -179.929 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 42.7 t80 -60.47 -41.34 93.97 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.176 -0.465 . . . . 74.450000000000003 110.884 -179.936 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 99.7 t -60.19 -49.46 84.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.165 -0.47 . . . . 72.239999999999995 111.162 179.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 29.7 tt0 -72.28 -23.47 61.19 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.191 -0.459 . . . . 75.530000000000001 110.911 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 10.8 tpt -74.99 -18.79 60.31 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.241 -0.436 . . . . 74.310000000000002 110.872 179.958 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 9.2 ttm -98.22 -32.93 11.31 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.214 -0.448 . . . . 74.329999999999998 110.894 179.94 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 5.0 t . . . . . 0 C--N 1.329 -0.309 0 CA-C-N 116.243 -0.435 . . . . 74.25 111.11 -179.91 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' M' M ' 15' ' ' LYS . . . . . . . . . . . . . 3.0 mttp . . . . . 0 C--O 1.23 0.075 0 CA-C-O 120.729 0.299 . . . . 74.299999999999997 110.901 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' M' M ' 16' ' ' TRP . . . . . . . . . . . . . 73.9 m95 -50.85 -32.74 21.26 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.199 -0.455 . . . . 71.230000000000004 110.929 179.918 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' M' M ' 17' ' ' GLU . . . . . . . . . . . . . 59.1 tt0 -54.08 -34.54 60.41 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.218 -0.447 . . . . 75.209999999999994 110.914 179.998 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' M' M ' 18' ' ' LYS . . . . . . . . . . . . . 23.4 tttp -65.16 -28.55 69.48 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.152 -0.476 . . . . 71.420000000000002 110.908 179.953 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' M' M ' 19' ' ' ILE . . . . . . . . . . . . . 28.6 mt -90.7 -29.98 4.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.214 -0.448 . . . . 73.140000000000001 111.157 179.879 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' M' M ' 20' ' ' ARG . . . . . . . . . . . . . 39.0 ttp85 . . . . . 0 C--N 1.329 -0.283 0 CA-C-N 116.147 -0.479 . . . . 75.430000000000007 110.87 179.928 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' M' M ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.133 0 CA-C-O 120.815 0.34 . . . . 75.140000000000001 110.891 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' M' M ' 31' ' ' LEU . . . . . . . . . . . . . 14.8 tp -124.39 -41.44 2.17 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.262 -0.426 . . . . 74.230000000000004 110.926 179.935 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' M' M ' 32' ' ' LYS . . . . . . . . . . . . . 42.6 tttt -49.57 -42.87 45.49 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.178 -0.465 . . . . 54.329999999999998 110.909 179.827 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' M' M ' 33' ' ' HIS . . . . . . . . . . . . . 80.7 t60 -50.33 -39.19 45.27 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.185 -0.461 . . . . 74.129999999999995 110.851 179.912 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' M' M ' 34' ' ' ILE . . . . . . . . . . . . . 62.3 mt -50.7 -39.46 18.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.204 -0.453 . . . . 75.230000000000004 111.138 179.987 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' M' M ' 35' ' ' VAL . . . . . . . . . . . . . 98.9 t -49.8 -39.22 14.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.129 -0.487 . . . . 74.439999999999998 111.158 179.863 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' M' M ' 36' ' ' TRP . . . . . . . . . . . . . 29.9 m0 -58.85 -39.16 80.48 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.139 -0.482 . . . . 75.329999999999998 110.933 179.965 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' M' M ' 37' ' ' ALA . . . . . . . . . . . . . . . -63.9 -18.59 64.36 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.216 -0.447 . . . . 62.340000000000003 111.117 179.88 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' M' M ' 38' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -73.94 -17.9 60.96 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.185 -0.461 . . . . 61.140000000000001 110.848 -179.742 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' M' M ' 39' ' ' ARG . . . . . . . . . . . . . 50.7 mtp180 -55.55 -31.4 62.11 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.131 -0.486 . . . . 72.129999999999995 110.85 -179.944 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' M' M ' 40' ' ' GLU . . . . . . . . . . . . . 14.3 tp10 -79.94 -46.53 16.55 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.156 -0.474 . . . . 74.209999999999994 110.89 -179.934 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' M' M ' 41' ' ' LEU . . . . . . . . . . . . . 11.9 mt . . . . . 0 C--N 1.328 -0.35 0 CA-C-N 116.14 -0.482 . . . . 74.150000000000006 110.89 -179.936 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 8.5 tp-100 . . . . . 0 C--O 1.232 0.139 0 CA-C-O 120.79 0.329 . . . . 72.230000000000004 110.942 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 59.2 mt -70.5 -43.33 78.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.238 -0.437 . . . . 73.319999999999993 111.116 179.932 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -52.11 -29.62 22.54 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.21 -0.45 . . . . 55.549999999999997 111.078 179.847 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 43.7 mm-40 -74.66 -52.0 12.84 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.28 -0.418 . . . . 73.129999999999995 110.882 -179.952 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 24.2 m-85 -61.91 -46.04 91.08 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.153 -0.476 . . . . 75.310000000000002 110.845 -179.88 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 34.1 ttmt -55.33 -26.98 44.07 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.117 -0.492 . . . . 74.310000000000002 110.95 179.962 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 56.4 tt0 -72.61 -38.72 67.72 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.222 -0.445 . . . . 74.420000000000002 110.888 179.927 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -63.77 -43.4 96.5 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.181 -0.463 . . . . 74.019999999999996 111.103 179.942 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 67.1 t80 -57.12 -53.7 55.06 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.197 -0.456 . . . . 74.5 110.904 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 46.9 m -52.35 -34.24 46.53 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.133 -0.485 . . . . 74.129999999999995 110.871 -179.795 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 16.6 tp -62.43 -46.68 87.46 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.09 -0.505 . . . . 70.230000000000004 110.913 179.996 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 46.2 m-85 -71.95 -25.98 62.1 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.2 -0.454 . . . . 72.439999999999998 110.877 179.933 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 13.9 t0 -82.69 98.54 9.11 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.138 -0.483 . . . . 72.310000000000002 110.852 179.995 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 15.8 ttmm -67.88 -51.76 44.37 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.168 -0.469 . . . . 72.239999999999995 110.863 -179.989 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 29.9 p-10 -79.57 -10.1 59.74 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.217 -0.447 . . . . 72.239999999999995 110.884 179.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 51.96 44.32 55.99 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.764 -0.732 . . . . 74.219999999999999 112.454 -179.938 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 17.2 p-10 -88.5 -15.72 34.55 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.813 0.339 . . . . 74.329999999999998 110.851 -179.989 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 102.24 17.09 21.19 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.716 -0.754 . . . . 64.109999999999999 112.521 -179.919 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -154.58 131.43 10.81 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.76 0.315 . . . . 65.099999999999994 111.133 -179.85 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 23.3 mt -92.51 111.67 24.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.256 -0.429 . . . . 73.349999999999994 111.128 179.941 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 19.6 p -97.78 178.21 5.22 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.2 -0.454 . . . . 72.319999999999993 111.093 -179.989 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 3.0 p -62.77 -27.19 69.12 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.205 -0.452 . . . . 73.239999999999995 111.184 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 7.8 mmmm -69.78 -50.09 46.56 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.173 -0.467 . . . . 74.239999999999995 110.899 179.93 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 -74.24 -32.71 63.08 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.214 -0.448 . . . . 74.120000000000005 110.899 179.95 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -74.14 -41.26 61.82 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.145 -0.479 . . . . 75.510000000000005 110.912 179.996 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -70.67 -34.43 66.93 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.801 -0.714 . . . . 75.219999999999999 112.5 179.887 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 96.7 m -67.43 -59.88 3.02 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.784 0.326 . . . . 72.420000000000002 111.136 -179.809 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 66.7 t -52.94 -52.11 31.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.194 -0.457 . . . . 72.329999999999998 111.132 179.903 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 6.3 ttt -51.93 -29.97 22.5 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.179 -0.464 . . . . 74.409999999999997 110.902 179.899 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 3.7 tmm_? -72.65 -52.85 13.64 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.17 -0.468 . . . . 71.109999999999999 110.884 -179.971 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 4.6 t -58.52 -25.69 62.69 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.23 -0.441 . . . . 74.329999999999998 110.907 -179.811 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 61.2 mt -78.15 -13.88 59.69 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.101 -0.5 . . . . 73.510000000000005 110.936 179.964 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 101.5 23.88 9.19 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.778 -0.725 . . . . 62.439999999999998 112.518 179.936 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 8.3 tp-100 -124.59 129.35 50.4 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.785 0.326 . . . . 72.530000000000001 110.931 -179.904 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 61.1 t30 -109.71 82.46 2.31 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.591 0.71 . . . . 74.230000000000004 110.902 -179.957 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.8 167.97 22.95 Favored 'Trans proline' 0 C--O 1.232 0.221 0 C-N-CA 122.72 2.28 . . . . 74.209999999999994 112.324 179.988 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 20.5 p -112.53 155.47 24.27 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.249 -0.432 . . . . 62.219999999999999 111.195 -179.993 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -51.91 -40.51 60.84 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.227 -0.442 . . . . 73.230000000000004 110.886 179.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.44 -31.46 63.83 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.145 -0.48 . . . . 73.049999999999997 111.112 179.973 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -70.76 -49.71 43.82 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.217 -0.447 . . . . 73.329999999999998 110.873 -179.933 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 13.9 mt -55.07 -51.0 67.73 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.175 -0.466 . . . . 72.329999999999998 110.926 -179.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 15.4 tp60 -59.93 -28.39 67.58 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.171 -0.468 . . . . 75.25 110.906 179.928 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 38.3 t0 -74.63 -49.96 19.55 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.22 -0.446 . . . . 73.25 110.865 -179.996 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 14.6 ptm -66.92 -42.49 85.29 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.212 -0.449 . . . . 73.209999999999994 110.894 179.976 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 97.1 mt -65.83 -38.11 81.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.149 -0.478 . . . . 65.530000000000001 111.12 179.97 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 33.6 m-20 -62.28 -36.17 81.25 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.18 -0.464 . . . . 65.150000000000006 110.847 179.959 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 24.9 mm-40 -63.62 -29.73 70.94 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.216 -0.447 . . . . 72.25 110.9 -179.963 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 9.7 m -105.34 12.68 8.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.151 -0.477 . . . . 74.439999999999998 111.114 179.967 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 30.7 t0 -90.01 98.73 11.94 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.232 -0.44 . . . . 73.0 110.857 179.953 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.34 -44.71 10.59 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.21 -0.45 . . . . 54.399999999999999 111.1 179.957 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 41.2 p30 -82.93 -0.2 47.43 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.219 -0.446 . . . . 74.230000000000004 110.837 -179.999 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 55.2 55.34 28.78 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.731 -0.747 . . . . 62.399999999999999 112.477 -179.927 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 48.7 p-10 -114.64 -15.74 11.92 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.891 0.376 . . . . 73.409999999999997 110.867 -179.895 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 92.71 19.14 38.39 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.799 -0.715 . . . . 64.510000000000005 112.478 179.96 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 26.7 p -146.52 165.91 28.04 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.749 0.309 . . . . 64.040000000000006 111.148 -179.881 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 18.5 mt -96.23 109.43 22.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.219 -0.446 . . . . 72.329999999999998 111.132 179.915 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -74.04 -177.81 3.06 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.205 -0.452 . . . . 71.510000000000005 110.901 179.839 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.518 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 2.5 t80 -61.6 -58.35 18.98 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.636 0.731 . . . . 75.230000000000004 110.891 -179.886 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . 0.518 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 53.9 Cg_endo -69.78 -29.73 23.3 Favored 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.668 2.245 . . . . 73.519999999999996 112.299 -179.991 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 80.6 mt-10 -58.57 -40.02 81.95 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.268 -0.424 . . . . 73.019999999999996 110.868 -179.963 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 50.4 t80 -73.79 -36.05 65.0 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.119 -0.491 . . . . 72.400000000000006 110.894 -179.923 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 16.4 tp -68.84 -53.84 19.12 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.177 -0.465 . . . . 73.25 110.932 -179.976 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 14.1 t -52.9 -28.45 23.34 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.214 -0.448 . . . . 75.430000000000007 111.154 179.964 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 39.6 ttp -65.24 -42.46 93.35 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.231 -0.441 . . . . 71.430000000000007 110.873 179.876 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -71.97 -35.75 69.61 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.218 -0.447 . . . . 72.450000000000003 110.848 179.975 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.237 -0.438 . . . . 75.5 111.078 179.926 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 51.4 mt . . . . . 0 C--O 1.23 0.07 0 CA-C-O 120.831 0.348 . . . . 74.140000000000001 111.181 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 51.2 ttt180 -66.04 -33.5 75.94 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.131 -0.486 . . . . 75.209999999999994 110.847 179.969 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -76.41 -34.94 58.8 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.241 -0.436 . . . . 71.219999999999999 110.878 -179.912 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -76.62 -34.49 58.35 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.149 -0.478 . . . . 63.020000000000003 111.086 179.94 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -61.57 -48.63 80.08 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.216 -0.447 . . . . 73.329999999999998 110.879 -179.936 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 12.9 ptm180 -60.76 -25.93 66.85 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.168 -0.469 . . . . 75.329999999999998 110.865 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 94.0 t -75.58 -51.21 21.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.234 -0.439 . . . . 74.239999999999995 111.136 179.98 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 8.9 m-85 -70.79 -26.61 63.4 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.184 -0.462 . . . . 73.409999999999997 110.882 -179.983 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 33.1 t0 -76.52 88.91 3.26 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.157 -0.474 . . . . 71.129999999999995 110.864 179.954 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 59.4 mmtt -75.31 -51.04 14.17 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.203 -0.453 . . . . 72.329999999999998 110.914 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 31.2 p30 -72.58 -9.08 58.15 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.233 -0.439 . . . . 72.319999999999993 110.882 179.857 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 59.96 27.72 65.06 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.765 -0.731 . . . . 73.420000000000002 112.527 -179.9 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 44.7 p-10 -82.88 -16.12 48.79 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.899 0.38 . . . . 74.5 110.909 -179.878 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 89.08 18.72 53.22 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.752 -0.737 . . . . 73.230000000000004 112.491 179.981 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 20.2 m-85 -137.51 152.39 49.44 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.824 0.345 . . . . 74.230000000000004 110.945 -179.798 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 65.2 mt -122.63 114.64 43.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.135 -0.484 . . . . 74.340000000000003 111.152 179.916 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 6.8 p -107.19 165.43 11.37 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.208 -0.451 . . . . 53.310000000000002 110.87 -179.926 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -51.85 -29.83 21.21 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.136 -0.484 . . . . 75.239999999999995 111.11 179.904 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -68.92 -43.11 75.83 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.191 -0.459 . . . . 75.430000000000007 111.096 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 83.5 mt-10 -76.8 -49.4 15.95 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.185 -0.461 . . . . 55.549999999999997 110.916 -179.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 24.3 tp -53.31 -47.62 69.1 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.187 -0.46 . . . . 75.150000000000006 110.891 -179.981 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 46.9 ttp180 -53.02 -31.31 40.45 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.219 -0.446 . . . . 75.409999999999997 110.887 179.954 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 63.0 t60 -69.27 -34.41 74.72 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.168 -0.469 . . . . 74.140000000000001 110.889 179.977 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 45.3 t -70.0 -32.24 50.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.238 -0.437 . . . . 75.420000000000002 111.113 -179.989 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 7.8 mmt -73.09 -43.75 61.36 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.158 -0.473 . . . . 74.510000000000005 110.844 179.931 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -54.99 -41.13 70.86 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.243 -0.435 . . . . 74.129999999999995 111.145 -179.907 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 61.0 m-20 -71.57 -32.24 67.86 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.203 -0.453 . . . . 72.409999999999997 110.88 179.997 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 5.0 mt -70.75 -25.75 63.05 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.148 -0.478 . . . . 75.439999999999998 110.923 179.959 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 101.07 32.42 5.3 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.787 -0.72 . . . . 65.209999999999994 112.454 179.88 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -113.75 109.97 19.42 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.896 0.379 . . . . 72.25 110.875 -179.861 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -66.61 108.08 2.32 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.159 -0.473 . . . . 74.200000000000003 110.876 179.984 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 10.4 mt -143.63 160.38 40.77 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.218 -0.446 . . . . 75.239999999999995 110.954 179.894 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 31.9 p -118.86 177.01 5.01 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.217 -0.447 . . . . 75.340000000000003 111.139 179.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -57.05 -43.74 82.3 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.245 -0.434 . . . . 65.299999999999997 110.845 179.938 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -65.0 -33.44 76.06 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.212 -0.449 . . . . 71.5 110.845 -179.87 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -70.12 -43.92 70.0 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.143 -0.48 . . . . 75.530000000000001 110.926 -179.974 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 48.6 t -59.19 -31.94 47.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.155 -0.475 . . . . 72.319999999999993 111.114 179.976 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 11.7 t0 -52.01 -42.77 63.28 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.226 -0.443 . . . . 74.040000000000006 110.856 179.916 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -55.76 -32.65 63.61 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.179 -0.464 . . . . 74.340000000000003 110.895 -179.909 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 30.8 mtp -76.05 -59.17 2.88 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.164 -0.471 . . . . 71.109999999999999 110.882 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 36.0 mm -53.92 -35.73 28.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.218 -0.446 . . . . 73.5 111.12 179.931 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 24.0 ttm180 -63.44 -31.85 73.13 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.178 -0.464 . . . . 75.239999999999995 110.898 179.944 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 21.0 tp10 -74.75 -52.38 11.68 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.161 -0.472 . . . . 72.209999999999994 110.842 -179.901 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -65.21 -34.41 78.3 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.159 -0.473 . . . . 75.329999999999998 111.088 179.982 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 49.4 t0 -68.42 86.74 0.3 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.217 -0.447 . . . . 52.130000000000003 110.882 179.968 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 60.6 mt -79.81 -46.15 22.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.172 -0.467 . . . . 71.530000000000001 111.126 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 21.2 p30 -72.78 -8.7 56.7 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.151 -0.477 . . . . 52.130000000000003 110.874 179.864 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 62.7 42.97 99.61 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.692 -0.766 . . . . 70.200000000000003 112.505 -179.933 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 34.6 p-10 -88.05 -15.98 34.84 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.825 0.345 . . . . 73.540000000000006 110.877 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 103.98 2.41 45.58 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.761 -0.733 . . . . 73.129999999999995 112.501 -179.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -149.15 172.26 15.11 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.829 0.347 . . . . 74.140000000000001 110.939 -179.88 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 136' ' ' VAL . . . . . . . . . . . . . 95.6 t -107.8 111.06 34.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.204 -0.453 . . . . 74.200000000000003 111.127 179.939 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 44.2 p-10 -92.82 165.95 12.66 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.153 -0.476 . . . . 73.239999999999995 110.88 -179.967 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 58.9 t80 -51.97 -46.47 64.84 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.207 -0.451 . . . . 75.540000000000006 110.905 -179.906 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 -51.99 -40.89 61.65 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.113 -0.494 . . . . 72.150000000000006 110.867 -179.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 20.7 mt-10 -78.34 -39.81 38.36 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.2 -0.455 . . . . 73.409999999999997 110.876 -179.926 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 52.4 t80 -61.17 -38.66 87.29 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.15 -0.477 . . . . 75.439999999999998 110.87 -179.888 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 93.8 t -71.26 -37.95 68.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.119 -0.491 . . . . 74.239999999999995 111.11 179.961 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 3.4 tp-100 -71.56 -31.25 66.79 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.185 -0.461 . . . . 73.310000000000002 110.895 -179.955 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 9.0 tpt -74.7 -42.43 58.39 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.193 -0.458 . . . . 73.540000000000006 110.867 179.964 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 9.6 ttm -79.34 -26.07 42.19 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.236 -0.438 . . . . 71.420000000000002 110.875 179.967 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 2.6 m . . . . . 0 C--N 1.329 -0.291 0 CA-C-N 116.23 -0.441 . . . . 70.420000000000002 111.14 -179.924 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' M' M ' 15' ' ' LYS . . . . . . . . . . . . . 60.9 mttp . . . . . 0 C--O 1.231 0.081 0 CA-C-O 120.744 0.307 . . . . 73.230000000000004 110.894 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' M' M ' 16' ' ' TRP . . . . . . . . . . . . . 19.7 m95 -54.34 -39.31 66.96 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.244 -0.434 . . . . 71.450000000000003 110.862 179.983 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' M' M ' 17' ' ' GLU . . . . . . . . . . . . . 41.0 tp10 -56.45 -26.81 54.97 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.243 -0.435 . . . . 74.439999999999998 110.883 -179.974 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' M' M ' 18' ' ' LYS . . . . . . . . . . . . . 6.9 ttpm? -78.61 -25.87 45.21 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.171 -0.468 . . . . 74.349999999999994 110.897 179.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' M' M ' 19' ' ' ILE . . . . . . . . . . . . . 29.6 mt -89.88 -25.22 5.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.187 -0.46 . . . . 73.5 111.14 179.874 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' M' M ' 20' ' ' ARG . . . . . . . . . . . . . 22.5 ttt180 . . . . . 0 C--N 1.329 -0.303 0 CA-C-N 116.174 -0.466 . . . . 74.400000000000006 110.903 179.956 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' M' M ' 30' ' ' LYS . . . . . . . . . . . . . 3.0 ttmm . . . . . 0 C--O 1.232 0.136 0 CA-C-O 120.783 0.325 . . . . 74.430000000000007 110.892 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' M' M ' 31' ' ' LEU . . . . . . . . . . . . . 9.5 tp -127.33 -52.28 1.39 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.196 -0.456 . . . . 75.439999999999998 110.933 179.926 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' M' M ' 32' ' ' LYS . . . . . . . . . . . . . 3.2 ttpp -47.65 -47.08 29.41 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.212 -0.449 . . . . 75.109999999999999 110.918 179.792 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' M' M ' 33' ' ' HIS . . . . . . . . . . . . . 74.8 t60 -50.45 -39.87 48.93 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.201 -0.454 . . . . 70.109999999999999 110.838 179.924 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' M' M ' 34' ' ' ILE . . . . . . . . . . . . . 50.1 mt -50.73 -39.27 18.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.236 -0.438 . . . . 75.420000000000002 111.123 -180.0 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' M' M ' 35' ' ' VAL . . . . . . . . . . . . . 61.1 t -49.27 -39.93 13.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.194 -0.457 . . . . 75.519999999999996 111.098 179.895 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' M' M ' 36' ' ' TRP . . . . . . . . . . . . . 22.8 m0 -59.02 -39.5 82.12 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.168 -0.469 . . . . 74.040000000000006 110.95 179.958 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' M' M ' 37' ' ' ALA . . . . . . . . . . . . . . . -63.71 -18.69 64.28 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.205 -0.452 . . . . 74.25 111.069 179.874 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' M' M ' 38' ' ' SER . . . . . . . . . . . . . 1.2 m -69.3 -17.96 63.78 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.24 -0.436 . . . . 72.5 110.871 -179.769 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' M' M ' 39' ' ' ARG . . . . . . . . . . . . . 26.4 ptt180 -56.11 -25.38 45.64 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.107 -0.497 . . . . 74.150000000000006 110.877 -179.916 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' M' M ' 40' ' ' GLU . . . . . . . . . . . . . 41.6 mm-40 -88.1 -47.99 8.07 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.188 -0.46 . . . . 54.43 110.914 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' M' M ' 41' ' ' LEU . . . . . . . . . . . . . 12.9 mt . . . . . 0 C--N 1.328 -0.34 0 CA-C-N 116.165 -0.47 . . . . 75.049999999999997 110.97 179.956 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 8.0 tp60 . . . . . 0 C--O 1.231 0.118 0 CA-C-O 120.784 0.326 . . . . 71.030000000000001 110.908 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 59.4 mt -72.56 -38.39 59.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.199 -0.455 . . . . 75.209999999999994 111.088 179.989 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -65.91 -27.02 67.88 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.228 -0.442 . . . . 61.039999999999999 111.137 179.807 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 20.6 mm-40 -74.83 -44.75 47.56 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.173 -0.467 . . . . 65.230000000000004 110.9 -179.933 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 23.8 m-85 -75.26 -45.81 37.68 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.157 -0.474 . . . . 63.229999999999997 110.853 -179.913 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 27.0 ttmt -56.36 -44.53 80.2 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.149 -0.478 . . . . 75.239999999999995 110.888 179.976 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -52.99 -32.65 47.61 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.202 -0.454 . . . . 72.400000000000006 110.84 -179.993 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -67.51 -42.2 83.23 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.193 -0.458 . . . . 72.040000000000006 111.109 179.916 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 66.6 t80 -56.07 -53.51 56.18 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.199 -0.455 . . . . 74.25 110.899 -179.914 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 70.9 m -55.85 -27.21 50.54 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.141 -0.481 . . . . 72.329999999999998 110.855 -179.796 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 15.5 tp -67.77 -40.25 84.04 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.182 -0.463 . . . . 74.5 110.947 179.964 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 59.5 m-85 -82.43 -34.48 28.2 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.228 -0.442 . . . . 75.109999999999999 110.853 179.93 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 11.0 t0 -69.47 98.52 1.12 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.192 -0.458 . . . . 65.310000000000002 110.859 -179.999 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 45.4 mmtt -72.09 -56.14 6.12 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.169 -0.469 . . . . 72.129999999999995 110.869 -179.978 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 26.5 p-10 -73.94 -10.01 59.22 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.2 -0.455 . . . . 53.409999999999997 110.876 179.893 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 51.99 44.6 56.41 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.762 -0.732 . . . . 74.129999999999995 112.529 -179.9 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 26.5 p-10 -88.51 -15.77 34.41 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.878 0.371 . . . . 72.530000000000001 110.89 -179.979 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 104.67 -11.72 50.08 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.74 -0.743 . . . . 72.019999999999996 112.47 -179.953 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 20.7 p -131.04 130.68 43.58 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.715 0.293 . . . . 74.430000000000007 111.166 -179.851 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 21.2 mt -90.47 130.84 39.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.292 -0.413 . . . . 70.530000000000001 111.096 179.919 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 29.8 p -108.75 -176.83 3.15 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.188 -0.46 . . . . 73.129999999999995 111.141 179.963 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 7.6 p -65.61 -41.5 92.69 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.247 -0.433 . . . . 73.209999999999994 111.126 -179.985 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 79.8 mttt -68.23 -50.15 55.91 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.206 -0.452 . . . . 73.150000000000006 110.902 179.935 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 27.4 mt-10 -56.36 -32.65 64.94 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.187 -0.461 . . . . 74.310000000000002 110.882 179.992 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -73.13 -43.14 62.07 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.156 -0.475 . . . . 63.039999999999999 110.926 179.988 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -69.73 -27.86 72.77 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.742 -0.742 . . . . 73.219999999999999 112.448 179.933 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 46.6 m -64.68 -59.51 4.18 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.841 0.353 . . . . 74.129999999999995 111.177 -179.896 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 99.9 t -57.38 -50.35 77.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.233 -0.439 . . . . 72.129999999999995 111.169 179.864 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 1.9 ttt -55.08 -30.42 59.63 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.166 -0.47 . . . . 75.109999999999999 110.907 179.88 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 23.9 ttm180 -60.1 -50.67 72.8 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.223 -0.444 . . . . 73.530000000000001 110.9 -179.96 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.6 t -61.34 -26.17 67.64 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.16 -0.473 . . . . 63.039999999999999 110.853 -179.751 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 58.2 mt -73.84 -20.5 60.42 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.096 -0.502 . . . . 74.040000000000006 110.93 179.963 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 101.5 29.62 6.21 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.715 -0.755 . . . . 75.230000000000004 112.467 179.886 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 10.5 mm-40 -127.46 133.97 49.87 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.796 0.331 . . . . 73.120000000000005 110.918 -179.882 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 10.7 t-20 -109.27 86.24 4.03 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.609 0.718 . . . . 75.420000000000002 110.875 -179.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.78 167.89 23.16 Favored 'Trans proline' 0 C--O 1.231 0.167 0 C-N-CA 122.709 2.272 . . . . 75.030000000000001 112.306 179.934 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 19.3 p -111.79 156.49 21.89 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.187 -0.461 . . . . 61.420000000000002 111.152 179.997 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 12.3 tp10 -51.97 -40.81 61.47 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.244 -0.435 . . . . 74.230000000000004 110.882 179.973 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.32 -39.37 65.33 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.159 -0.473 . . . . 73.010000000000005 111.109 179.943 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -60.47 -52.58 64.58 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.258 -0.428 . . . . 72.420000000000002 110.886 -179.924 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 19.7 mt -55.27 -48.52 73.89 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.163 -0.471 . . . . 74.219999999999999 110.89 -179.956 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.84 -41.94 71.33 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.196 -0.456 . . . . 73.219999999999999 110.894 179.977 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 51.0 t0 -57.99 -43.2 86.45 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.175 -0.466 . . . . 72.040000000000006 110.878 179.949 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 5.8 mtp -62.9 -55.36 26.75 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.205 -0.452 . . . . 73.25 110.873 179.989 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 65.5 mt -53.24 -53.66 22.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.201 -0.454 . . . . 75.230000000000004 111.144 179.95 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 6.5 m-20 -61.73 -37.67 85.06 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.203 -0.453 . . . . 71.219999999999999 110.88 179.936 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 -60.02 -33.16 71.64 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.163 -0.471 . . . . 72.310000000000002 110.914 179.986 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 32.8 m -109.97 20.2 6.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.126 -0.488 . . . . 73.049999999999997 111.141 179.95 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 29.3 t0 -90.11 99.15 12.22 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.157 -0.474 . . . . 63.299999999999997 110.83 179.947 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.35 -40.19 13.76 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.163 -0.471 . . . . 63.43 111.071 179.956 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 13.0 p-10 -86.64 -0.12 55.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.235 -0.439 . . . . 74.420000000000002 110.859 179.981 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 52.46 56.81 15.8 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.738 -0.744 . . . . 74.109999999999999 112.504 -179.911 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 52.1 p-10 -114.48 -15.89 11.99 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.877 0.37 . . . . 74.519999999999996 110.921 -179.93 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 91.65 17.79 47.38 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.695 -0.764 . . . . 72.25 112.445 179.981 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 25.1 p -150.49 162.38 40.71 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.721 0.296 . . . . 75.239999999999995 111.168 -179.814 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 20.3 mt -97.86 109.39 23.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.242 -0.435 . . . . 74.109999999999999 111.121 179.941 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -75.84 -172.69 2.01 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.218 -0.447 . . . . 73.430000000000007 110.864 179.878 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.521 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 2.5 t80 -64.91 -58.15 13.77 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.644 0.735 . . . . 74.540000000000006 110.909 -179.948 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . 0.521 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 54.3 Cg_endo -69.71 -27.83 26.25 Favored 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.669 2.246 . . . . 72.019999999999996 112.364 179.977 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 14.0 mt-10 -59.75 -41.06 90.13 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.221 -0.445 . . . . 73.239999999999995 110.864 -179.939 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 24.0 t80 -73.99 -36.11 64.49 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.164 -0.471 . . . . 74.430000000000007 110.924 -179.982 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 24.0 tp -68.14 -53.89 21.92 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.141 -0.481 . . . . 74.420000000000002 110.921 -179.987 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 14.8 t -54.92 -30.85 59.47 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.2 -0.455 . . . . 70.530000000000001 111.124 179.972 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 44.1 ttp -58.94 -38.3 78.69 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.216 -0.447 . . . . 73.420000000000002 110.86 179.919 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -75.65 -36.66 60.09 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.214 -0.448 . . . . 72.099999999999994 110.884 179.965 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.296 0 CA-C-N 116.224 -0.444 . . . . 70.129999999999995 111.085 179.92 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 76.5 mt . . . . . 0 N--CA 1.458 -0.071 0 CA-C-O 120.807 0.336 . . . . 64.209999999999994 111.11 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 25.9 ttt85 -71.44 -42.27 68.43 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.138 -0.483 . . . . 73.439999999999998 110.859 179.962 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 18.0 tt0 -62.31 -56.93 13.67 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.215 -0.448 . . . . 74.439999999999998 110.89 -179.896 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -53.35 -51.03 63.75 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.152 -0.476 . . . . 74.209999999999994 111.082 179.935 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 17.1 t80 -53.16 -43.41 67.03 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.2 -0.455 . . . . 73.140000000000001 110.933 -179.928 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 59.6 ttp180 -69.19 -34.29 74.69 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.127 -0.488 . . . . 72.230000000000004 110.846 -179.886 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 96.1 t -66.07 -40.73 88.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.139 -0.482 . . . . 74.340000000000003 111.167 179.967 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 8.3 m-85 -76.81 -31.92 57.27 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.129 -0.487 . . . . 75.129999999999995 110.843 -179.972 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 21.5 t0 -71.29 85.4 0.79 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.158 -0.473 . . . . 62.020000000000003 110.869 -180.0 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 11.5 ptpt -78.72 -40.58 33.25 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.175 -0.466 . . . . 74.329999999999998 110.876 -179.995 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 55.2 p-10 -75.01 -9.17 58.28 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.202 -0.454 . . . . 60.43 110.842 179.883 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 59.55 26.81 62.72 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.74 -0.743 . . . . 71.340000000000003 112.504 -179.885 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 35.8 p-10 -84.22 -16.13 44.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.879 0.371 . . . . 74.019999999999996 110.888 -179.901 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 80.98 18.26 70.25 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.744 -0.741 . . . . 70.549999999999997 112.482 -179.996 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 20.7 m-85 -140.83 142.24 34.61 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.84 0.352 . . . . 72.140000000000001 110.948 -179.789 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 62.3 mt -103.48 126.44 57.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.172 -0.467 . . . . 75.109999999999999 111.12 179.913 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 93.0 p -107.28 -175.63 2.84 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.193 -0.458 . . . . 74.150000000000006 110.896 -179.942 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -73.27 -31.56 64.16 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.115 -0.493 . . . . 74.209999999999994 111.088 179.928 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -71.07 -47.08 60.41 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.234 -0.439 . . . . 75.230000000000004 111.087 179.935 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 69.9 mt-10 -69.16 -44.02 73.12 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.254 -0.43 . . . . 75.510000000000005 110.917 -179.914 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 35.8 tp -53.42 -42.32 66.94 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.104 -0.498 . . . . 75.430000000000007 110.928 -179.989 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 8.9 ttt-85 -63.98 -49.33 72.94 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.223 -0.444 . . . . 75.5 110.858 179.975 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 18.9 t60 -54.22 -34.39 60.52 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.212 -0.449 . . . . 63.299999999999997 110.877 179.951 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 95.2 t -73.34 -29.98 29.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.194 -0.457 . . . . 71.209999999999994 111.098 179.995 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 44.4 tpp -73.29 -53.76 10.06 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.226 -0.443 . . . . 63.140000000000001 110.884 179.939 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 2.1 t -51.75 -30.18 21.66 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.198 -0.455 . . . . 75.439999999999998 111.13 -179.923 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 6.7 m120 -65.06 -37.45 87.6 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.2 -0.455 . . . . 75.400000000000006 110.932 179.979 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 17.3 mt -72.12 -9.72 58.8 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.182 -0.463 . . . . 71.0 110.916 179.919 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 101.08 29.18 6.53 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.736 -0.745 . . . . 74.439999999999998 112.503 179.923 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 12.4 tp10 -133.01 110.06 9.98 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.953 0.406 . . . . 72.439999999999998 110.885 -179.907 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 31.0 tttt -85.69 120.42 27.1 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.133 -0.485 . . . . 75.319999999999993 110.879 179.96 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 61.1 mt -124.54 153.58 41.9 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.191 -0.459 . . . . 74.319999999999993 110.921 179.895 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 45.5 p -89.55 162.83 15.47 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.18 -0.464 . . . . 65.219999999999999 111.154 179.964 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 94.7 m-20 -53.56 -38.78 64.19 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.206 -0.452 . . . . 60.420000000000002 110.882 179.935 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -68.23 -34.3 75.98 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.186 -0.461 . . . . 73.219999999999999 110.92 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 19.9 tp10 -67.12 -42.3 84.75 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.117 -0.492 . . . . 75.340000000000003 110.902 -179.962 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 63.6 t -60.34 -34.54 57.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.124 -0.489 . . . . 74.230000000000004 111.127 179.976 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -51.95 -46.95 64.95 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.199 -0.455 . . . . 73.129999999999995 110.837 179.92 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 35.2 tp10 -57.6 -29.26 64.36 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.214 -0.448 . . . . 75.299999999999997 110.867 -179.875 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 35.4 mtp -75.96 -58.06 3.5 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.162 -0.472 . . . . 73.049999999999997 110.862 -179.996 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 33.3 mm -54.0 -35.31 28.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.213 -0.449 . . . . 75.200000000000003 111.109 179.982 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 51.8 ttm-85 -69.01 -31.72 70.75 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.199 -0.455 . . . . 74.409999999999997 110.897 179.952 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -69.01 -40.5 78.65 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.134 -0.485 . . . . 72.549999999999997 110.888 -179.944 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -83.82 -27.34 28.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.133 -0.485 . . . . 73.329999999999998 111.105 179.946 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 50.7 t0 -74.54 86.6 2.09 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.21 -0.45 . . . . 73.340000000000003 110.881 179.944 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 90.1 mt -80.08 -45.57 22.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.239 -0.437 . . . . 74.400000000000006 111.152 179.966 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 16.6 p30 -71.43 -8.93 57.05 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.152 -0.476 . . . . 54.43 110.83 179.916 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 63.13 43.01 99.33 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.711 -0.756 . . . . 74.310000000000002 112.49 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 17.2 p-10 -88.9 -15.91 33.2 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.864 0.364 . . . . 73.299999999999997 110.826 -179.934 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 100.36 5.33 54.45 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.721 -0.752 . . . . 63.409999999999997 112.434 -179.966 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -149.33 172.16 15.35 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.821 0.343 . . . . 74.420000000000002 110.918 -179.823 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 136' ' ' VAL . . . . . . . . . . . . . 98.4 t -113.63 115.97 51.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.234 -0.439 . . . . 72.450000000000003 111.097 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 45.9 p-10 -93.87 167.83 11.37 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.183 -0.462 . . . . 73.340000000000003 110.862 179.978 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 61.3 t80 -53.2 -41.94 65.8 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.159 -0.473 . . . . 75.129999999999995 110.948 -179.958 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 22.9 tp10 -57.11 -40.62 77.43 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.119 -0.491 . . . . 72.109999999999999 110.927 180.0 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -78.52 -29.94 46.79 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.088 -0.505 . . . . 75.099999999999994 110.859 -179.934 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 53.7 t80 -71.97 -37.1 69.97 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.184 -0.462 . . . . 74.450000000000003 110.918 -179.938 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 85.7 t -64.74 -44.94 96.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.12 -0.491 . . . . 73.140000000000001 111.165 179.929 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 42.2 tt0 -63.04 -27.97 69.77 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.161 -0.472 . . . . 71.120000000000005 110.906 -179.988 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 3.9 tpt -74.61 -54.96 6.45 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.183 -0.462 . . . . 75.010000000000005 110.859 180.0 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 12.8 ttm -65.54 -27.23 68.3 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.217 -0.447 . . . . 70.239999999999995 110.871 179.951 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 1.3 m . . . . . 0 C--N 1.329 -0.309 0 CA-C-N 116.243 -0.435 . . . . 73.230000000000004 111.149 -179.916 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' M' M ' 15' ' ' LYS . . . . . . . . . . . . . 16.2 mttm . . . . . 0 C--O 1.232 0.157 0 CA-C-O 120.777 0.322 . . . . 73.430000000000007 110.904 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' M' M ' 16' ' ' TRP . . . . . . . . . . . . . 34.3 m95 -52.06 -39.08 59.12 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.257 -0.428 . . . . 73.310000000000002 110.872 179.977 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' M' M ' 17' ' ' GLU . . . . . . . . . . . . . 17.2 tt0 -55.73 -34.2 64.94 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.255 -0.429 . . . . 71.319999999999993 110.89 -179.977 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' M' M ' 18' ' ' LYS . . . . . . . . . . . . . 6.3 ttmm -68.52 -22.18 64.53 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.198 -0.456 . . . . 75.230000000000004 110.862 -179.995 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' M' M ' 19' ' ' ILE . . . . . . . . . . . . . 24.2 mm -69.76 -33.61 57.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.192 -0.458 . . . . 64.329999999999998 111.119 179.868 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' M' M ' 20' ' ' ARG . . . . . . . . . . . . . 35.0 ttp180 . . . . . 0 C--N 1.329 -0.31 0 CA-C-N 116.194 -0.457 . . . . 75.129999999999995 110.871 179.978 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' M' M ' 30' ' ' LYS . . . . . . . . . . . . . 9.2 tttt . . . . . 0 C--O 1.232 0.164 0 CA-C-O 120.785 0.326 . . . . 74.340000000000003 110.88 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' M' M ' 31' ' ' LEU . . . . . . . . . . . . . 8.1 tp -96.47 -36.19 10.88 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.279 -0.418 . . . . 74.319999999999993 110.914 179.959 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' M' M ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -47.41 -34.4 7.11 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.139 -0.482 . . . . 64.340000000000003 110.886 179.855 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' M' M ' 33' ' ' HIS . . . . . . . . . . . . . 3.4 t60 -52.02 -45.78 64.72 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.212 -0.449 . . . . 74.230000000000004 110.868 179.926 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' M' M ' 34' ' ' ILE . . . . . . . . . . . . . 60.8 mt -51.82 -35.32 17.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.142 -0.481 . . . . 74.049999999999997 111.136 179.97 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' M' M ' 35' ' ' VAL . . . . . . . . . . . . . 46.2 t -49.95 -39.58 15.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.194 -0.457 . . . . 75.409999999999997 111.143 179.865 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' M' M ' 36' ' ' TRP . . . . . . . . . . . . . 18.3 m0 -58.79 -39.48 81.18 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.14 -0.482 . . . . 75.239999999999995 110.976 179.907 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' M' M ' 37' ' ' ALA . . . . . . . . . . . . . . . -63.85 -18.52 64.24 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.229 -0.441 . . . . 63.149999999999999 111.102 179.859 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' M' M ' 38' ' ' SER . . . . . . . . . . . . . 1.4 m -68.75 -17.81 64.11 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.242 -0.435 . . . . 63.310000000000002 110.842 -179.765 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' M' M ' 39' ' ' ARG . . . . . . . . . . . . . 51.3 mtp85 -51.73 -29.97 20.62 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.136 -0.484 . . . . 74.510000000000005 110.884 -179.968 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' M' M ' 40' ' ' GLU . . . . . . . . . . . . . 28.7 mm-40 -80.07 -47.28 15.09 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.192 -0.458 . . . . 74.319999999999993 110.908 -179.939 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' M' M ' 41' ' ' LEU . . . . . . . . . . . . . 8.3 mt . . . . . 0 C--N 1.328 -0.34 0 CA-C-N 116.108 -0.496 . . . . 75.329999999999998 110.932 -179.984 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 8.2 tp-100 . . . . . 0 C--O 1.232 0.163 0 CA-C-O 120.787 0.327 . . . . 74.319999999999993 110.932 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 4.4 mp -71.41 -38.64 69.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.217 -0.447 . . . . 75.400000000000006 111.134 179.957 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -53.42 -40.13 64.88 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.154 -0.476 . . . . 75.450000000000003 111.127 179.795 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -74.65 -50.48 17.57 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.17 -0.468 . . . . 62.109999999999999 110.884 -179.927 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 16.5 m-85 -55.89 -37.62 69.08 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.16 -0.473 . . . . 62.439999999999998 110.904 -179.926 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 26.1 tttm -54.63 -37.27 65.43 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.155 -0.475 . . . . 75.310000000000002 110.935 179.916 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -68.24 -34.18 75.76 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.239 -0.437 . . . . 74.010000000000005 110.889 179.997 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -67.68 -28.21 67.49 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.141 -0.481 . . . . 51.229999999999997 111.082 179.934 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 91.0 t80 -75.64 -54.22 7.33 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.251 -0.432 . . . . 74.430000000000007 110.863 -179.897 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 9.4 t -54.32 -27.57 36.59 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.209 -0.451 . . . . 72.310000000000002 110.812 -179.769 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 16.3 tp -65.18 -38.87 91.89 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.179 -0.464 . . . . 74.209999999999994 110.928 -179.992 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 19.8 m-85 -81.46 -24.76 36.59 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.198 -0.455 . . . . 71.239999999999995 110.911 179.932 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 11.7 t0 -83.35 98.6 9.55 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.139 -0.482 . . . . 65.120000000000005 110.788 179.996 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 21.1 mmmt -67.27 -50.96 58.4 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.16 -0.473 . . . . 74.209999999999994 110.907 179.933 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 22.2 p-10 -80.93 -10.16 59.75 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.217 -0.447 . . . . 70.109999999999999 110.893 179.86 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 51.64 42.3 51.64 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.746 -0.74 . . . . 74.319999999999993 112.481 -179.969 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 34.1 p-10 -88.25 -15.15 36.64 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.838 0.351 . . . . 75.329999999999998 110.858 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 105.4 -11.18 47.13 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.711 -0.756 . . . . 42.439999999999998 112.502 -179.924 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 7.3 p -127.97 130.75 48.9 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.791 0.329 . . . . 72.5 111.162 -179.882 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 22.0 mt -104.29 109.79 28.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.222 -0.444 . . . . 73.519999999999996 111.127 179.913 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 20.1 p -95.47 -176.88 3.9 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.173 -0.467 . . . . 72.439999999999998 111.144 179.964 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 69.5 p -66.11 -27.45 68.06 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.21 -0.45 . . . . 74.329999999999998 111.168 -179.99 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.07 -49.99 17.9 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.172 -0.467 . . . . 72.420000000000002 110.928 179.885 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 23.8 mt-10 -70.61 -40.15 73.34 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.198 -0.455 . . . . 71.430000000000007 110.863 179.967 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 3.8 tt -74.31 -49.69 21.93 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.195 -0.457 . . . . 75.230000000000004 110.857 -179.914 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -54.63 -31.5 52.99 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.731 -0.747 . . . . 71.030000000000001 112.509 179.905 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 96.3 m -73.38 -47.04 45.33 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.814 0.34 . . . . 73.200000000000003 111.125 -179.856 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 51.7 t -54.54 -54.34 23.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.229 -0.441 . . . . 75.239999999999995 111.151 179.892 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 8.2 ptm -65.72 -36.73 84.44 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.136 -0.484 . . . . 64.230000000000004 110.872 179.932 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 52.4 ttt85 -54.31 -37.31 64.68 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.244 -0.434 . . . . 63.130000000000003 110.921 -179.962 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -70.04 -23.63 63.13 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.2 -0.455 . . . . 74.329999999999998 110.883 -179.816 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 18.3 mt -85.59 -10.72 55.45 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.121 -0.491 . . . . 73.549999999999997 110.919 179.978 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 101.78 22.49 10.14 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.772 -0.728 . . . . 73.030000000000001 112.482 179.871 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 3.8 mp0 -121.22 96.81 5.24 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.787 0.327 . . . . 74.140000000000001 110.935 -179.891 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 52.5 t30 -109.89 79.34 1.45 Allowed Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.63 0.729 . . . . 71.349999999999994 110.908 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.79 168.21 22.25 Favored 'Trans proline' 0 C--O 1.232 0.205 0 C-N-CA 122.685 2.256 . . . . 71.120000000000005 112.344 179.964 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 24.7 p -79.22 159.9 27.13 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.224 -0.444 . . . . 75.319999999999993 111.146 -179.969 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -51.66 -45.72 63.49 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.197 -0.456 . . . . 73.439999999999998 110.88 -179.958 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -68.42 -31.39 70.7 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.142 -0.481 . . . . 72.030000000000001 111.081 179.969 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 76.9 tt0 -69.7 -44.81 69.65 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.261 -0.427 . . . . 74.310000000000002 110.834 -179.922 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 27.3 mt -56.35 -51.88 66.65 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.165 -0.471 . . . . 73.129999999999995 110.913 -179.958 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 24.2 tp60 -66.1 -28.03 68.51 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.183 -0.462 . . . . 75.140000000000001 110.879 179.958 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 23.4 t0 -56.26 -49.66 73.57 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.183 -0.462 . . . . 60.229999999999997 110.845 -179.977 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 8.0 ptp -74.07 -36.91 64.36 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.216 -0.447 . . . . 72.129999999999995 110.934 179.953 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 91.1 mt -62.55 -38.27 81.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.218 -0.446 . . . . 71.019999999999996 111.128 179.966 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 15.1 m-20 -66.61 -24.66 66.35 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.181 -0.463 . . . . 75.5 110.891 179.952 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -76.22 -26.53 56.18 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.129 -0.487 . . . . 71.450000000000003 110.875 179.978 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 4.4 m -108.41 8.39 9.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.202 -0.454 . . . . 74.430000000000007 111.161 179.956 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 30.8 t0 -82.99 98.39 9.23 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.15 -0.477 . . . . 74.409999999999997 110.84 179.936 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.28 -43.02 11.87 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.203 -0.453 . . . . 62.219999999999999 111.067 179.961 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 43.5 p30 -84.26 -0.12 51.08 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.191 -0.459 . . . . 73.5 110.882 179.974 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 54.84 54.8 31.13 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.756 -0.735 . . . . 73.319999999999993 112.497 -179.933 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 49.7 p-10 -114.56 -15.67 11.97 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.875 0.369 . . . . 75.230000000000004 110.893 -179.869 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 94.16 18.56 36.21 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.744 -0.741 . . . . 72.310000000000002 112.527 179.994 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 20.4 p -145.62 175.52 10.3 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.776 0.322 . . . . 73.400000000000006 111.082 -179.844 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 18.9 mt -108.75 110.6 32.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.194 -0.457 . . . . 73.450000000000003 111.132 179.922 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.0 t0 -76.02 -172.93 2.15 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.199 -0.455 . . . . 64.230000000000004 110.862 179.9 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.509 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 2.4 t80 -64.76 -58.19 13.96 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-O 121.675 0.75 . . . . 72.129999999999995 110.893 -179.878 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . 0.509 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 54.0 Cg_endo -69.72 -26.8 27.41 Favored 'Trans proline' 0 C--N 1.342 0.208 0 C-N-CA 122.696 2.264 . . . . 73.010000000000005 112.331 179.972 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 63.0 mt-10 -61.59 -40.46 94.85 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.232 -0.44 . . . . 71.150000000000006 110.918 -179.976 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 25.1 t80 -74.44 -35.83 63.37 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.163 -0.471 . . . . 74.540000000000006 110.86 -179.93 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 35.3 tp -69.61 -54.06 15.79 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.107 -0.497 . . . . 75.239999999999995 110.914 -179.94 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 14.6 t -52.82 -30.38 33.07 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.182 -0.463 . . . . 62.119999999999997 111.151 179.966 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 39.2 ttp -60.4 -51.23 70.36 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.197 -0.456 . . . . 74.530000000000001 110.88 179.91 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 5.2 mmt -70.24 -46.03 65.28 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.244 -0.434 . . . . 74.319999999999993 110.906 179.956 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.319 0 CA-C-N 116.228 -0.442 . . . . 73.420000000000002 111.093 179.912 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 68.8 mt . . . . . 0 C--O 1.231 0.097 0 CA-C-O 120.788 0.327 . . . . 72.450000000000003 111.104 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 34.9 ttm180 -63.41 -28.23 69.84 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.2 -0.455 . . . . 73.25 110.855 179.957 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -63.8 -50.91 67.12 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.245 -0.434 . . . . 63.009999999999998 110.84 -179.889 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -66.13 -44.02 85.41 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.195 -0.457 . . . . 75.019999999999996 111.1 179.962 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 5.7 t80 -51.97 -48.02 64.55 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.184 -0.462 . . . . 74.319999999999993 110.863 -179.921 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 4.3 ttt-85 -63.78 -39.9 95.38 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.157 -0.474 . . . . 72.439999999999998 110.864 -179.911 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 90.4 t -59.37 -33.53 51.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.213 -0.448 . . . . 73.230000000000004 111.142 179.982 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 8.6 m-85 -89.98 -26.19 20.49 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.191 -0.458 . . . . 75.510000000000005 110.89 -179.986 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 17.1 t0 -73.97 95.6 2.52 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.16 -0.473 . . . . 60.119999999999997 110.834 -179.999 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 13.5 mtpt -78.67 -53.25 7.35 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.224 -0.444 . . . . 74.409999999999997 110.922 179.963 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 48.9 p30 -73.55 -9.15 58.38 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.239 -0.437 . . . . 74.549999999999997 110.909 179.841 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 60.35 31.54 74.26 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.724 -0.75 . . . . 72.400000000000006 112.494 -179.92 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 45.6 p-10 -86.24 -16.2 38.42 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.856 0.36 . . . . 75.209999999999994 110.879 -179.891 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 89.91 18.73 49.98 Favored Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.69 -0.767 . . . . 62.350000000000001 112.492 -179.975 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 14.1 m-85 -134.58 155.68 50.02 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.921 0.391 . . . . 74.25 110.912 -179.839 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 68.5 mt -122.77 121.44 63.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.136 -0.484 . . . . 72.109999999999999 111.11 179.957 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 59.7 p -114.59 176.53 5.01 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.172 -0.467 . . . . 71.519999999999996 110.872 -179.899 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -66.08 -24.95 66.81 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.133 -0.485 . . . . 71.510000000000005 111.113 179.909 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -71.81 -49.91 34.39 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.164 -0.471 . . . . 62.32 111.108 179.949 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -76.63 -47.77 21.21 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.213 -0.449 . . . . 74.340000000000003 110.855 -179.877 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 23.5 tp -52.95 -50.75 63.43 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.183 -0.462 . . . . 72.030000000000001 110.909 -179.974 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 64.2 ttt-85 -52.32 -37.81 56.91 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.199 -0.455 . . . . 75.230000000000004 110.897 179.942 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 43.6 t60 -58.93 -34.4 71.7 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.14 -0.482 . . . . 72.239999999999995 110.873 179.982 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 21.7 t -74.47 -49.12 32.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.217 -0.447 . . . . 72.040000000000006 111.123 179.955 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 3.9 mmt -64.91 -27.16 68.66 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.185 -0.461 . . . . 75.219999999999999 110.894 179.921 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 18.9 p -75.32 -48.3 23.77 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.238 -0.437 . . . . 71.430000000000007 111.164 -179.944 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 12.2 t30 -56.61 -26.62 56.13 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.241 -0.436 . . . . 75.310000000000002 110.889 179.967 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 6.6 mt -70.72 -22.52 62.43 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.184 -0.462 . . . . 73.430000000000007 110.92 179.958 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 101.09 33.09 5.06 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.771 -0.728 . . . . 74.109999999999999 112.444 179.882 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 24.7 mm-40 -122.28 109.97 15.11 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.899 0.38 . . . . 74.219999999999999 110.871 -179.89 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 28.0 tptt -65.44 137.1 57.23 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.188 -0.46 . . . . 74.140000000000001 110.874 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 48.2 mt -145.76 150.71 36.73 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.209 -0.45 . . . . 74.5 110.914 179.929 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 73.2 p -100.49 170.05 8.65 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.219 -0.446 . . . . 74.140000000000001 111.145 179.96 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -53.06 -44.61 67.6 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.25 -0.432 . . . . 74.319999999999993 110.845 179.891 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 -70.38 -45.44 66.04 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.239 -0.437 . . . . 74.209999999999994 110.884 -179.891 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -55.08 -32.18 61.77 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.185 -0.461 . . . . 74.209999999999994 110.898 -179.948 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 73.9 t -69.59 -30.85 46.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.206 -0.452 . . . . 74.319999999999993 111.143 179.964 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -78.49 -28.52 46.36 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.12 -0.491 . . . . 72.140000000000001 110.878 179.9 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -55.74 -50.01 71.55 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.172 -0.467 . . . . 74.439999999999998 110.876 -179.867 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 12.4 ptm -66.72 -44.31 81.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.167 -0.47 . . . . 74.019999999999996 110.929 179.911 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 28.4 mm -53.94 -35.43 28.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.216 -0.447 . . . . 64.120000000000005 111.153 179.956 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 23.0 ttp180 -66.8 -31.78 72.63 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.16 -0.473 . . . . 74.540000000000006 110.844 179.95 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 10.1 tm-20 -68.83 -40.0 79.68 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.187 -0.461 . . . . 75.420000000000002 110.857 -179.928 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -82.57 -29.6 30.17 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.178 -0.464 . . . . 71.109999999999999 111.105 179.951 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 43.3 t0 -68.39 86.91 0.29 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.23 -0.441 . . . . 73.230000000000004 110.915 179.949 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 81.3 mt -79.69 -48.42 20.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.173 -0.467 . . . . 65.129999999999995 111.16 -179.955 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 18.7 p30 -73.01 -8.6 56.45 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.157 -0.474 . . . . 72.120000000000005 110.835 179.846 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 63.49 43.05 98.72 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.739 -0.743 . . . . 43.240000000000002 112.517 -179.915 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 25.8 p-10 -89.53 -15.8 32.13 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.868 0.366 . . . . 65.329999999999998 110.856 -179.909 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 102.96 3.51 48.73 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.723 -0.751 . . . . 70.200000000000003 112.484 179.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -149.14 172.11 15.34 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.852 0.358 . . . . 72.340000000000003 110.905 -179.84 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 136' ' ' VAL . . . . . . . . . . . . . 82.7 t -107.67 109.18 27.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.211 -0.45 . . . . 71.530000000000001 111.149 179.937 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 20.8 p30 -92.04 164.76 13.49 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.183 -0.462 . . . . 75.129999999999995 110.888 -179.978 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 15.5 t80 -52.3 -45.73 65.66 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.172 -0.467 . . . . 73.439999999999998 110.909 -179.868 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -52.01 -40.07 60.42 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.155 -0.475 . . . . 75.239999999999995 110.864 -179.986 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 24.2 mt-10 -78.42 -48.47 15.38 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.223 -0.444 . . . . 75.450000000000003 110.856 -179.928 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 47.6 t80 -54.17 -40.55 67.59 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.123 -0.489 . . . . 74.140000000000001 110.878 -179.916 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 92.6 t -69.23 -38.77 78.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.138 -0.483 . . . . 73.519999999999996 111.145 179.981 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 50.8 tt0 -68.66 -41.23 79.63 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.153 -0.476 . . . . 73.420000000000002 110.943 -179.992 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -74.73 -51.81 13.24 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.198 -0.455 . . . . 63.119999999999997 110.857 179.979 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 32.9 tpp -51.92 -30.11 22.95 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.209 -0.451 . . . . 71.310000000000002 110.929 179.901 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 89.6 m . . . . . 0 C--N 1.329 -0.292 0 CA-C-N 116.236 -0.438 . . . . 70.319999999999993 111.133 -179.95 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' M' M ' 15' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.23 0.078 0 CA-C-O 120.798 0.332 . . . . 74.400000000000006 110.873 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' M' M ' 16' ' ' TRP . . . . . . . . . . . . . 32.2 m95 -56.59 -28.13 59.61 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.228 -0.442 . . . . 74.219999999999999 110.887 179.947 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' M' M ' 17' ' ' GLU . . . . . . . . . . . . . 9.5 tt0 -54.04 -30.26 47.1 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.267 -0.424 . . . . 73.430000000000007 110.916 -179.992 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' M' M ' 18' ' ' LYS . . . . . . . . . . . . . 2.3 ttmp? -60.77 -25.96 66.89 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.132 -0.485 . . . . 74.209999999999994 110.878 179.969 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' M' M ' 19' ' ' ILE . . . . . . . . . . . . . 29.4 mt -103.5 -42.06 7.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.245 -0.434 . . . . 74.349999999999994 111.161 179.866 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' M' M ' 20' ' ' ARG . . . . . . . . . . . . . 46.0 ttp180 . . . . . 0 C--N 1.329 -0.308 0 CA-C-N 116.174 -0.466 . . . . 74.519999999999996 110.839 -179.969 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' M' M ' 30' ' ' LYS . . . . . . . . . . . . . 5.4 ttmm . . . . . 0 C--O 1.231 0.121 0 CA-C-O 120.831 0.348 . . . . 54.25 110.903 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' M' M ' 31' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -118.52 -28.93 5.58 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.195 -0.457 . . . . 73.420000000000002 110.908 179.918 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' M' M ' 32' ' ' LYS . . . . . . . . . . . . . 1.8 mttp -48.9 -44.44 40.16 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.184 -0.462 . . . . 55.100000000000001 110.875 179.823 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' M' M ' 33' ' ' HIS . . . . . . . . . . . . . 56.5 t-80 -50.26 -39.78 46.05 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.212 -0.449 . . . . 71.219999999999999 110.908 179.903 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' M' M ' 34' ' ' ILE . . . . . . . . . . . . . 29.2 mt -50.31 -39.86 17.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.182 -0.463 . . . . 72.200000000000003 111.137 179.974 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' M' M ' 35' ' ' VAL . . . . . . . . . . . . . 61.2 t -48.81 -40.71 12.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.204 -0.453 . . . . 63.210000000000001 111.096 179.844 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' M' M ' 36' ' ' TRP . . . . . . . . . . . . . 21.4 m0 -59.2 -39.74 83.57 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.214 -0.448 . . . . 74.510000000000005 110.916 -179.995 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' M' M ' 37' ' ' ALA . . . . . . . . . . . . . . . -63.21 -18.7 63.8 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.226 -0.443 . . . . 73.420000000000002 111.089 179.858 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' M' M ' 38' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -66.29 -18.03 65.11 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.259 -0.428 . . . . 75.209999999999994 110.857 -179.792 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' M' M ' 39' ' ' ARG . . . . . . . . . . . . . 12.5 ptt180 -55.62 -25.74 40.45 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.109 -0.496 . . . . 74.349999999999994 110.866 -179.946 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' M' M ' 40' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -91.3 -47.97 7.18 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.203 -0.453 . . . . 73.310000000000002 110.894 -179.931 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' M' M ' 41' ' ' LEU . . . . . . . . . . . . . 10.8 mt . . . . . 0 C--N 1.328 -0.326 0 CA-C-N 116.182 -0.463 . . . . 75.409999999999997 110.88 -179.97 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 13.8 tt0 . . . . . 0 C--O 1.232 0.164 0 CA-C-O 120.776 0.322 . . . . 75.400000000000006 110.896 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 3.3 mp -65.96 -50.35 70.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.232 -0.44 . . . . 74.230000000000004 111.133 179.973 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -56.02 -25.47 44.68 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.189 -0.46 . . . . 71.450000000000003 111.12 179.812 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 14.2 tp10 -75.17 -38.39 60.91 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.206 -0.452 . . . . 72.140000000000001 110.856 -179.948 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 54.2 m-85 -76.28 -46.13 29.32 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.175 -0.466 . . . . 73.420000000000002 110.911 -179.908 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 7.8 ptmm? -57.25 -29.39 63.77 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.183 -0.462 . . . . 73.200000000000003 110.919 179.945 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -66.82 -37.54 84.72 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.194 -0.457 . . . . 74.040000000000006 110.889 179.939 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -67.03 -37.17 83.64 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.159 -0.473 . . . . 71.409999999999997 111.089 179.934 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 77.4 t80 -59.45 -54.31 48.14 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.227 -0.442 . . . . 64.540000000000006 110.878 -179.895 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 41.5 t -56.3 -28.13 57.77 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.118 -0.492 . . . . 74.510000000000005 110.833 -179.767 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 15.5 tp -65.5 -40.79 93.47 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.138 -0.483 . . . . 74.299999999999997 110.894 -179.985 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 43.1 m-85 -80.49 -24.67 39.26 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.2 -0.454 . . . . 74.409999999999997 110.858 179.973 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 9.8 t0 -79.44 98.61 6.85 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.165 -0.471 . . . . 75.0 110.849 179.998 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.68 -47.06 82.74 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.193 -0.458 . . . . 64.5 110.816 -179.966 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 24.4 p-10 -86.89 -10.21 53.89 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.246 -0.434 . . . . 74.420000000000002 110.905 179.894 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 51.41 46.23 52.63 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.728 -0.749 . . . . 75.0 112.49 -179.953 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 29.5 p-10 -88.73 -14.06 38.13 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.843 0.354 . . . . 72.549999999999997 110.89 -179.984 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 105.35 13.41 24.66 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.788 -0.72 . . . . 53.539999999999999 112.491 -179.95 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 1.4 p -154.65 142.26 19.82 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.772 0.32 . . . . 54.140000000000001 111.108 -179.872 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 25.1 mt -101.84 124.99 56.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.209 -0.45 . . . . 75.099999999999994 111.102 179.943 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 39.5 p -110.05 174.83 5.68 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.188 -0.46 . . . . 71.239999999999995 111.141 179.929 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 61.0 p -61.07 -31.89 71.54 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.178 -0.464 . . . . 72.5 111.134 179.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.84 -49.93 12.11 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.224 -0.444 . . . . 75.219999999999999 110.906 179.937 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 23.3 mt-10 -61.26 -33.62 73.84 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.211 -0.45 . . . . 63.539999999999999 110.908 179.958 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.1 tt -74.24 -55.11 6.43 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.12 -0.491 . . . . 72.420000000000002 110.926 -179.994 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -52.22 -27.87 24.98 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.747 -0.74 . . . . 74.120000000000005 112.461 179.948 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 54.8 m -63.69 -59.18 4.92 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.797 0.332 . . . . 73.329999999999998 111.12 -179.861 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 36.3 t -52.62 -49.29 45.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.208 -0.451 . . . . 74.099999999999994 111.09 179.957 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 28.2 mtp -51.83 -35.79 45.75 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.186 -0.461 . . . . 75.099999999999994 110.907 179.904 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 24.5 ttp180 -55.73 -51.88 65.84 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.199 -0.455 . . . . 74.209999999999994 110.891 -179.942 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 3.8 t -66.45 -28.5 68.65 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.179 -0.464 . . . . 75.120000000000005 110.87 -179.816 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 57.6 mt -77.14 -24.3 51.62 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.111 -0.495 . . . . 72.400000000000006 110.924 179.963 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 101.35 32.8 5.08 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.756 -0.735 . . . . 70.510000000000005 112.477 179.89 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 17.6 mm-40 -131.09 105.42 7.7 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.853 0.358 . . . . 65.209999999999994 110.897 -179.874 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 59.9 t30 -109.86 76.93 1.01 Allowed Pre-proline 0 C--N 1.33 -0.282 0 CA-C-O 121.619 0.723 . . . . 71.439999999999998 110.878 -179.948 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.83 168.01 22.88 Favored 'Trans proline' 0 C--O 1.231 0.162 0 C-N-CA 122.67 2.247 . . . . 72.120000000000005 112.315 179.965 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 76.7 p -86.95 157.53 19.47 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.209 -0.45 . . . . 74.319999999999993 111.14 -179.958 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -52.28 -39.22 60.17 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.233 -0.44 . . . . 74.340000000000003 110.88 179.984 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -72.13 -32.96 67.41 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.203 -0.453 . . . . 64.219999999999999 111.092 179.946 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 10.1 tt0 -69.7 -49.71 50.79 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.191 -0.458 . . . . 75.219999999999999 110.886 -179.916 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 34.1 mt -55.14 -43.08 73.84 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.163 -0.471 . . . . 73.540000000000006 110.885 -179.955 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 19.4 tp60 -56.42 -33.63 66.01 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.151 -0.477 . . . . 74.140000000000001 110.895 179.951 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -70.18 -37.52 75.16 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.233 -0.439 . . . . 74.409999999999997 110.863 179.988 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 39.6 mtp -65.22 -57.84 7.49 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.204 -0.453 . . . . 75.25 110.88 -179.994 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 62.4 mt -57.61 -42.64 81.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.21 -0.45 . . . . 73.400000000000006 111.167 179.96 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 48.6 m-20 -59.28 -37.19 77.03 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.146 -0.479 . . . . 72.409999999999997 110.842 179.936 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -65.69 -29.87 70.48 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.209 -0.451 . . . . 75.140000000000001 110.88 -179.993 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 14.7 m -103.15 6.64 10.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.144 -0.48 . . . . 75.400000000000006 111.142 179.979 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 31.3 t0 -90.11 96.63 10.76 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.125 -0.489 . . . . 74.120000000000005 110.869 179.927 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.18 -42.0 12.61 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.184 -0.462 . . . . 70.319999999999993 111.118 179.956 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -85.02 0.01 52.9 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.234 -0.439 . . . . 45.210000000000001 110.849 179.99 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 55.03 57.98 15.81 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.754 -0.736 . . . . 74.340000000000003 112.519 -179.924 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 52.2 p-10 -114.6 -15.7 11.95 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.871 0.367 . . . . 72.439999999999998 110.92 -179.917 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 90.06 16.91 55.18 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.738 -0.744 . . . . 74.109999999999999 112.446 179.917 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 46.9 p -151.35 162.85 40.2 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.735 0.302 . . . . 73.099999999999994 111.158 -179.846 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 19.9 mt -96.94 116.99 40.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.184 -0.462 . . . . 74.140000000000001 111.124 179.921 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.4 t0 -81.12 -172.95 4.02 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.199 -0.455 . . . . 74.0 110.864 179.865 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.51 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 2.5 t80 -64.93 -58.4 12.96 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.64 0.733 . . . . 74.540000000000006 110.92 -179.932 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . 0.51 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 54.1 Cg_endo -69.76 -28.73 24.89 Favored 'Trans proline' 0 C--N 1.341 0.158 0 C-N-CA 122.681 2.254 . . . . 72.319999999999993 112.379 179.937 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 23.8 mt-10 -58.24 -45.45 87.73 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.218 -0.447 . . . . 73.430000000000007 110.88 179.992 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 13.2 t80 -71.37 -36.43 71.44 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.149 -0.478 . . . . 72.439999999999998 110.892 -179.948 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 15.3 tp -64.09 -53.7 45.63 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.169 -0.469 . . . . 74.040000000000006 110.922 -179.972 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 14.8 t -61.26 -29.46 69.86 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.189 -0.46 . . . . 75.219999999999999 111.153 179.94 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 5.6 tmm? -63.31 -43.83 96.72 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.223 -0.444 . . . . 74.530000000000001 110.885 179.902 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -79.49 -30.01 41.85 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.223 -0.444 . . . . 73.310000000000002 110.864 179.984 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.257 0 CA-C-N 116.238 -0.437 . . . . 71.349999999999994 111.09 179.924 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 49.8 mt . . . . . 0 N--CA 1.457 -0.106 0 CA-C-O 120.853 0.359 . . . . 75.430000000000007 111.135 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 2.2 tpm_? -70.78 -53.58 14.91 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.15 -0.477 . . . . 74.409999999999997 110.855 179.974 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 1.6 pp20? -60.44 -39.87 89.06 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.18 -0.463 . . . . 65.450000000000003 110.894 -179.933 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -59.58 -48.51 81.39 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.148 -0.478 . . . . 61.210000000000001 111.086 179.946 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 9.1 t80 -52.08 -44.93 64.59 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.27 -0.423 . . . . 74.239999999999995 110.841 -179.87 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 6.5 tpt180 -66.38 -40.77 89.9 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.178 -0.464 . . . . 75.140000000000001 110.858 -179.91 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 92.4 t -58.4 -33.85 48.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.202 -0.454 . . . . 75.200000000000003 111.153 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 9.9 m-85 -87.52 -36.86 17.37 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.161 -0.472 . . . . 72.150000000000006 110.874 -180.0 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 17.6 t0 -61.3 96.05 0.05 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.151 -0.477 . . . . 64.239999999999995 110.847 -179.979 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 7.2 mtmp? -78.63 -52.55 8.28 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.16 -0.473 . . . . 74.209999999999994 110.924 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 32.7 p30 -75.45 -9.14 58.31 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.253 -0.431 . . . . 73.510000000000005 110.872 179.855 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 60.61 31.9 76.55 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.758 -0.734 . . . . 64.209999999999994 112.46 -179.972 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 48.6 p-10 -83.13 -16.1 48.09 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.879 0.371 . . . . 73.519999999999996 110.909 -179.931 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 86.72 18.7 57.9 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.77 -0.728 . . . . 73.510000000000005 112.489 179.99 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 6.4 m-85 -137.52 147.89 45.56 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.851 0.358 . . . . 73.349999999999994 110.942 -179.853 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 62.3 mt -112.7 112.9 42.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.117 -0.492 . . . . 74.129999999999995 111.111 179.919 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 52.0 p -107.05 -174.23 2.48 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.139 -0.482 . . . . 72.420000000000002 110.847 -179.915 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -67.71 -32.25 72.76 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.112 -0.495 . . . . 71.209999999999994 111.086 179.927 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -69.88 -45.33 67.91 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.18 -0.464 . . . . 72.129999999999995 111.098 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 18.4 mt-10 -75.32 -51.24 13.66 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.197 -0.456 . . . . 72.030000000000001 110.89 -179.942 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 47.2 tp -53.48 -43.28 68.05 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.157 -0.474 . . . . 73.219999999999999 110.925 -179.982 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 56.1 ttp180 -56.21 -49.39 74.22 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.224 -0.444 . . . . 74.439999999999998 110.903 179.931 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 80.0 t60 -54.44 -34.92 62.36 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.21 -0.45 . . . . 75.519999999999996 110.841 -179.995 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 81.0 t -67.02 -46.2 85.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.201 -0.454 . . . . 75.0 111.16 179.93 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 3.3 mmt -69.47 -25.14 63.93 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.133 -0.485 . . . . 74.450000000000003 110.885 179.923 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 7.4 m -74.12 -56.26 5.13 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.185 -0.461 . . . . 71.099999999999994 111.132 -179.891 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 6.4 t-20 -56.75 -26.79 58.21 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.234 -0.439 . . . . 73.209999999999994 110.849 -179.984 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 19.3 mt -70.74 -22.25 62.44 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.178 -0.464 . . . . 73.340000000000003 110.914 179.987 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 101.09 33.02 5.08 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.757 -0.735 . . . . 71.420000000000002 112.467 179.859 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 24.7 tp10 -110.25 163.24 13.83 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.928 0.394 . . . . 75.140000000000001 110.901 -179.889 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 48.0 mttp -116.92 103.57 10.42 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.19 -0.459 . . . . 75.219999999999999 110.904 179.958 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 17.9 mt -131.25 113.22 13.55 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.183 -0.462 . . . . 73.310000000000002 110.9 179.932 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 34.3 p -72.04 172.72 9.56 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.169 -0.469 . . . . 73.439999999999998 111.133 179.951 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 69.1 m-20 -51.91 -38.14 55.13 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.184 -0.462 . . . . 73.439999999999998 110.895 179.908 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 50.4 tp10 -71.7 -35.99 70.41 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.189 -0.46 . . . . 74.140000000000001 110.891 -179.901 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -63.55 -40.0 95.87 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.153 -0.476 . . . . 74.310000000000002 110.872 -179.93 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 60.1 t -62.72 -43.68 98.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.179 -0.464 . . . . 72.329999999999998 111.107 -179.965 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 39.8 t0 -57.06 -55.13 38.7 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.19 -0.459 . . . . 71.450000000000003 110.851 179.906 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 10.9 tm-20 -56.25 -29.28 60.86 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.157 -0.474 . . . . 72.040000000000006 110.887 -179.893 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 24.6 ttt -68.01 -59.95 2.87 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.146 -0.479 . . . . 73.540000000000006 110.853 -179.965 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 31.4 mm -53.98 -35.78 29.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.235 -0.439 . . . . 74.109999999999999 111.092 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 31.6 ttp180 -61.12 -31.73 71.42 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.2 -0.454 . . . . 74.25 110.914 179.949 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 11.8 tm-20 -72.23 -46.27 56.76 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.185 -0.461 . . . . 75.349999999999994 110.881 -179.943 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -73.37 -25.52 60.62 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.173 -0.467 . . . . 70.519999999999996 111.101 179.938 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 38.8 t0 -68.07 87.34 0.27 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.205 -0.452 . . . . 73.129999999999995 110.878 179.975 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 70.5 mt -79.91 -48.12 20.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.195 -0.457 . . . . 74.200000000000003 111.151 179.988 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 18.9 p30 -75.1 -8.65 57.14 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.183 -0.462 . . . . 75.430000000000007 110.847 179.869 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 63.99 45.18 94.64 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.742 -0.742 . . . . 54.130000000000003 112.522 -179.884 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 35.3 p-10 -92.21 -15.84 27.01 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.867 0.365 . . . . 74.549999999999997 110.882 -179.977 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 103.46 2.83 47.36 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.772 -0.728 . . . . 33.210000000000001 112.522 -179.931 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -149.22 172.23 15.18 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.871 0.367 . . . . 75.230000000000004 110.952 -179.926 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 136' ' ' VAL . . . . . . . . . . . . . 49.1 t -108.49 113.25 43.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.21 -0.45 . . . . 73.430000000000007 111.132 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 16.3 p30 -93.17 172.1 8.52 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.159 -0.473 . . . . 75.040000000000006 110.924 179.997 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 88.6 t80 -54.91 -47.33 74.49 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.212 -0.449 . . . . 74.430000000000007 110.962 -179.922 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 25.1 tt0 -51.96 -49.72 62.63 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.094 -0.503 . . . . 74.340000000000003 110.886 -179.979 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 14.7 mt-10 -66.46 -32.68 74.2 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.18 -0.464 . . . . 70.430000000000007 110.825 -179.88 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 37.5 t80 -66.33 -45.32 80.64 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.177 -0.465 . . . . 72.030000000000001 110.926 -179.952 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 66.8 t -69.53 -39.64 78.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.101 -0.499 . . . . 75.099999999999994 111.113 179.962 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 30.6 tt0 -62.28 -57.83 9.96 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.2 -0.455 . . . . 74.109999999999999 110.856 -179.964 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 11.6 tpt -56.57 -30.73 63.48 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.256 -0.429 . . . . 72.349999999999994 110.882 179.966 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 5.6 ttm -75.87 -37.22 59.13 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.219 -0.446 . . . . 72.219999999999999 110.935 179.934 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 1.9 m . . . . . 0 C--N 1.33 -0.28 0 CA-C-N 116.16 -0.473 . . . . 55.240000000000002 111.158 -179.927 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' M' M ' 15' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.119 0 CA-C-O 120.763 0.316 . . . . 73.430000000000007 110.914 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' M' M ' 16' ' ' TRP . . . . . . . . . . . . . 6.1 m95 -58.1 -37.16 73.99 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.246 -0.434 . . . . 72.239999999999995 110.957 179.917 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' M' M ' 17' ' ' GLU . . . . . . . . . . . . . 11.9 tt0 -60.27 -22.06 62.64 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.24 -0.436 . . . . 74.049999999999997 110.911 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' M' M ' 18' ' ' LYS . . . . . . . . . . . . . 19.9 ttpp -65.31 -24.79 67.37 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.137 -0.483 . . . . 75.310000000000002 110.896 179.941 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' M' M ' 19' ' ' ILE . . . . . . . . . . . . . 33.1 mt -97.09 -23.14 4.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.219 -0.446 . . . . 65.430000000000007 111.088 179.927 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' M' M ' 20' ' ' ARG . . . . . . . . . . . . . 37.1 ttp85 . . . . . 0 C--N 1.329 -0.311 0 CA-C-N 116.17 -0.468 . . . . 75.400000000000006 110.87 179.986 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' M' M ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.169 0 CA-C-O 120.806 0.336 . . . . 74.25 110.878 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' M' M ' 31' ' ' LEU . . . . . . . . . . . . . 11.8 tp -157.59 -49.89 0.07 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.259 -0.428 . . . . 72.530000000000001 110.928 179.902 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' M' M ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.43 -35.89 41.41 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.21 -0.45 . . . . 73.129999999999995 110.882 179.826 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' M' M ' 33' ' ' HIS . . . . . . . . . . . . . 13.0 t-80 -50.86 -38.72 50.96 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.189 -0.46 . . . . 64.299999999999997 110.853 179.908 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' M' M ' 34' ' ' ILE . . . . . . . . . . . . . 49.5 mm -50.03 -38.7 14.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.243 -0.435 . . . . 74.450000000000003 111.153 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' M' M ' 35' ' ' VAL . . . . . . . . . . . . . 40.9 t -50.17 -40.17 17.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.182 -0.463 . . . . 74.030000000000001 111.142 179.854 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' M' M ' 36' ' ' TRP . . . . . . . . . . . . . 20.9 m0 -59.66 -36.57 76.68 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.19 -0.459 . . . . 75.519999999999996 110.893 179.977 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' M' M ' 37' ' ' ALA . . . . . . . . . . . . . . . -63.62 -18.83 64.33 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.239 -0.437 . . . . 74.200000000000003 111.076 179.901 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' M' M ' 38' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -73.67 -17.94 61.08 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.208 -0.451 . . . . 74.310000000000002 110.858 -179.754 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' M' M ' 39' ' ' ARG . . . . . . . . . . . . . 14.2 ttt180 -55.0 -26.58 37.92 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.1 -0.5 . . . . 75.340000000000003 110.888 -179.976 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' M' M ' 40' ' ' GLU . . . . . . . . . . . . . 3.5 pt-20 -84.58 -32.21 23.91 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.166 -0.47 . . . . 74.349999999999994 110.868 -179.896 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' M' M ' 41' ' ' LEU . . . . . . . . . . . . . 11.2 mt . . . . . 0 C--N 1.328 -0.367 0 CA-C-N 116.146 -0.479 . . . . 73.150000000000006 110.929 -179.985 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 47.8 tt0 . . . . . 0 C--O 1.231 0.106 0 CA-C-O 120.77 0.319 . . . . 72.310000000000002 110.922 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 52.8 mt -72.9 -40.93 60.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.183 -0.462 . . . . 74.329999999999998 111.145 179.983 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.41 -28.15 69.58 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.124 -0.489 . . . . 73.150000000000006 111.144 179.756 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 19.5 mm-40 -74.93 -52.14 11.97 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.214 -0.448 . . . . 63.539999999999999 110.88 -179.909 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 26.3 m-85 -66.89 -45.99 76.28 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.156 -0.475 . . . . 73.120000000000005 110.88 -179.919 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -52.92 -46.17 67.95 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.143 -0.48 . . . . 72.5 110.931 179.948 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -54.93 -30.84 59.54 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.188 -0.46 . . . . 73.230000000000004 110.868 -179.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -69.52 -45.29 69.18 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.172 -0.467 . . . . 73.120000000000005 111.08 179.933 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 85.5 t80 -54.75 -54.26 44.31 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.191 -0.459 . . . . 75.329999999999998 110.903 -179.906 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 10.6 t -61.58 -26.38 67.93 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.15 -0.477 . . . . 61.119999999999997 110.902 -179.806 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 2.9 tt -65.31 -40.03 93.23 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.104 -0.498 . . . . 72.439999999999998 110.911 -179.994 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 36.1 m-85 -77.6 -34.62 53.39 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.147 -0.478 . . . . 73.019999999999996 110.881 179.965 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 15.9 t0 -67.21 98.57 0.62 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.134 -0.484 . . . . 61.240000000000002 110.892 179.998 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 23.3 mmtp -72.06 -56.46 5.58 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.226 -0.443 . . . . 70.150000000000006 110.893 -179.994 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 17.1 p-10 -71.01 -10.24 59.4 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.19 -0.459 . . . . 72.010000000000005 110.877 179.859 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 51.54 71.21 0.69 Allowed Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.751 -0.738 . . . . 75.230000000000004 112.438 -179.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 22.7 p-10 -114.52 -15.75 11.99 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.874 0.368 . . . . 72.420000000000002 110.884 179.995 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 101.21 12.37 36.48 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.718 -0.753 . . . . 71.25 112.484 -179.926 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 1.9 p -154.66 144.47 21.62 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.743 0.306 . . . . 74.430000000000007 111.133 -179.853 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 22.2 mt -102.93 114.46 42.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.237 -0.438 . . . . 71.219999999999999 111.109 179.934 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 19.2 p -102.06 174.91 5.72 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.146 -0.479 . . . . 74.329999999999998 111.172 179.945 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 69.9 p -61.0 -29.97 70.01 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.198 -0.455 . . . . 72.040000000000006 111.149 -179.979 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 32.3 mtmt -79.89 -50.12 10.93 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.258 -0.428 . . . . 74.329999999999998 110.841 179.96 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 -63.34 -35.91 81.95 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.234 -0.439 . . . . 73.319999999999993 110.919 179.981 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.0 tt -74.25 -52.2 13.06 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.121 -0.49 . . . . 75.430000000000007 110.927 179.983 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -52.17 -29.2 28.48 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.782 -0.723 . . . . 52.219999999999999 112.477 179.928 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 95.5 m -66.07 -58.91 4.42 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.853 0.359 . . . . 64.420000000000002 111.125 -179.828 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 94.2 t -54.39 -45.95 69.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.216 -0.447 . . . . 72.140000000000001 111.141 179.902 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 1.9 mmm -52.18 -38.24 57.2 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.198 -0.455 . . . . 73.209999999999994 110.858 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 3.8 tmt_? -55.55 -52.74 62.72 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.214 -0.448 . . . . 72.299999999999997 110.921 -179.95 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 5.9 t -59.89 -29.74 68.53 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.184 -0.462 . . . . 74.140000000000001 110.889 -179.813 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 48.2 mt -80.26 -21.46 42.72 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.099 -0.5 . . . . 74.040000000000006 110.93 179.957 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 101.46 31.02 5.68 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.754 -0.736 . . . . 63.219999999999999 112.448 179.868 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -127.4 113.45 16.24 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.814 0.34 . . . . 73.530000000000001 110.917 -179.924 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 32.3 t-20 -109.87 81.22 1.95 Allowed Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.628 0.728 . . . . 73.329999999999998 110.857 -179.96 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.72 167.95 22.92 Favored 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.673 2.249 . . . . 73.510000000000005 112.395 179.887 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 20.2 p -98.44 157.46 16.2 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.239 -0.437 . . . . 63.329999999999998 111.153 -179.97 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -52.02 -45.19 64.49 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.245 -0.434 . . . . 74.540000000000006 110.834 -179.952 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -71.07 -31.65 68.1 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.209 -0.45 . . . . 73.310000000000002 111.124 179.914 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -66.67 -49.19 66.94 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.206 -0.452 . . . . 73.109999999999999 110.871 -179.914 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 16.3 mt -55.17 -50.65 68.77 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.142 -0.481 . . . . 74.430000000000007 110.936 -179.96 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 24.6 tp60 -60.19 -28.6 68.1 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.155 -0.475 . . . . 73.439999999999998 110.947 179.919 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 45.4 t0 -74.18 -49.8 21.97 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.19 -0.459 . . . . 71.340000000000003 110.87 -179.99 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 15.6 ptm -66.95 -41.65 86.58 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.153 -0.476 . . . . 75.319999999999993 110.926 179.974 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 96.9 mt -66.76 -37.95 80.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.204 -0.453 . . . . 74.299999999999997 111.15 179.931 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 37.9 m-20 -63.2 -24.9 68.09 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.143 -0.48 . . . . 64.010000000000005 110.842 179.982 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 15.9 mm-40 -73.09 -41.2 64.33 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.194 -0.457 . . . . 74.209999999999994 110.886 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 32.6 m -86.37 -17.5 9.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.134 -0.485 . . . . 74.409999999999997 111.138 179.991 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 39.0 t0 -66.84 94.1 0.3 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.146 -0.479 . . . . 74.549999999999997 110.825 179.978 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.3 -29.79 20.11 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.183 -0.462 . . . . 71.209999999999994 111.037 179.974 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -92.86 -0.19 57.29 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.256 -0.429 . . . . 70.150000000000006 110.874 -179.976 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 52.18 60.11 8.07 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.739 -0.743 . . . . 61.210000000000001 112.498 -179.922 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 44.8 p-10 -114.43 -15.88 12.01 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.896 0.379 . . . . 64.409999999999997 110.902 -179.911 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 96.22 8.34 57.77 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.724 -0.75 . . . . 72.209999999999994 112.436 179.947 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 71.9 p -150.61 175.11 12.24 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.772 0.32 . . . . 73.209999999999994 111.131 -179.853 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 19.3 mt -101.67 115.6 43.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.204 -0.453 . . . . 65.129999999999995 111.146 179.874 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 27.4 m-20 -78.46 -172.88 3.08 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.155 -0.475 . . . . 61.310000000000002 110.905 179.837 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.514 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 2.5 t80 -64.83 -58.37 13.28 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 121.632 0.73 . . . . 74.230000000000004 110.847 -179.838 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . 0.514 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 54.1 Cg_endo -69.75 -31.01 21.41 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.674 2.249 . . . . 74.310000000000002 112.34 -179.997 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 19.9 mt-10 -57.45 -41.86 81.37 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.2 -0.455 . . . . 73.519999999999996 110.863 -179.942 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 10.6 t80 -73.93 -36.07 64.65 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.174 -0.467 . . . . 73.230000000000004 110.908 -179.921 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 16.8 tp -66.68 -53.92 28.67 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.146 -0.479 . . . . 75.430000000000007 110.878 -179.986 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 15.3 t -56.21 -31.23 63.3 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.2 -0.455 . . . . 74.310000000000002 111.117 179.962 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 41.4 ttp -60.05 -50.37 73.99 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.237 -0.438 . . . . 73.439999999999998 110.848 179.95 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -52.83 -44.67 66.88 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.257 -0.429 . . . . 73.25 110.901 179.93 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.289 0 CA-C-N 116.189 -0.46 . . . . 63.530000000000001 111.104 179.937 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 32.4 mt . . . . . 0 C--O 1.231 0.109 0 CA-C-O 120.838 0.351 . . . . 63.399999999999999 111.108 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 2.3 tmt_? -56.26 -53.63 54.95 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.187 -0.461 . . . . 72.230000000000004 110.856 -179.987 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 11.7 tm-20 -56.77 -56.08 26.06 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.173 -0.467 . . . . 75.049999999999997 110.885 -179.948 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -53.33 -50.93 63.97 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.204 -0.453 . . . . 65.030000000000001 111.113 179.921 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 5.1 t80 -61.03 -35.15 76.14 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.237 -0.438 . . . . 74.430000000000007 110.832 -179.888 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 14.8 ttt-85 -72.42 -27.48 62.36 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.136 -0.484 . . . . 74.239999999999995 110.911 -179.928 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 86.2 t -75.12 -28.02 20.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.176 -0.465 . . . . 75.120000000000005 111.14 179.98 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 8.7 m-85 -95.72 -30.34 13.79 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.152 -0.476 . . . . 75.030000000000001 110.872 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 43.7 t0 -76.68 89.41 3.36 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.168 -0.469 . . . . 72.319999999999993 110.883 179.995 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 34.0 mmtt -78.02 -48.77 15.41 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.185 -0.461 . . . . 70.349999999999994 110.929 179.982 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 9.5 p30 -72.58 -9.09 58.16 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.237 -0.438 . . . . 74.109999999999999 110.841 179.903 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 60.04 28.83 66.95 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.7 -0.762 . . . . 65.239999999999995 112.504 -179.933 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 43.8 p-10 -81.89 -16.1 51.77 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.89 0.376 . . . . 73.530000000000001 110.915 -179.885 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 82.36 18.72 65.93 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.746 -0.74 . . . . 44.140000000000001 112.5 179.966 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 19.0 m-85 -137.56 136.63 37.78 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.849 0.357 . . . . 54.030000000000001 110.917 -179.76 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 79.9 mt -106.05 124.94 61.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.141 -0.482 . . . . 72.129999999999995 111.112 179.939 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 40.2 p -116.45 176.22 5.21 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.175 -0.466 . . . . 72.310000000000002 110.883 -179.945 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -60.28 -38.88 84.95 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.12 -0.491 . . . . 65.549999999999997 111.13 179.881 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -62.42 -39.6 93.83 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.211 -0.449 . . . . 63.109999999999999 111.074 179.933 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 54.6 mt-10 -73.46 -51.56 16.76 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.207 -0.451 . . . . 73.439999999999998 110.874 -179.926 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 17.2 tp -56.2 -44.52 79.54 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.195 -0.457 . . . . 73.040000000000006 110.918 -179.955 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 27.5 ttt180 -52.59 -49.2 65.48 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.211 -0.45 . . . . 72.450000000000003 110.832 179.958 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 81.0 t60 -65.57 -34.81 79.11 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.18 -0.463 . . . . 74.319999999999993 110.86 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 91.2 t -59.18 -52.28 62.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.229 -0.442 . . . . 73.450000000000003 111.145 179.974 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 2.2 tpt -56.16 -36.35 68.21 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.19 -0.459 . . . . 72.209999999999994 110.875 179.893 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -53.56 -35.26 60.58 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.261 -0.427 . . . . 71.409999999999997 111.129 -179.917 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 5.2 t30 -74.53 -26.57 60.06 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.197 -0.456 . . . . 74.209999999999994 110.897 -179.985 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 15.4 mt -77.73 -25.37 49.25 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.141 -0.481 . . . . 75.099999999999994 110.894 179.976 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 101.07 32.97 5.11 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.716 -0.754 . . . . 62.32 112.498 179.877 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 21.2 mm-40 -129.43 110.11 11.62 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.931 0.396 . . . . 75.129999999999995 110.85 -179.852 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 20.8 pttp -72.59 135.83 45.63 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.104 -0.498 . . . . 74.409999999999997 110.901 179.961 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 75.0 mt -138.23 157.57 46.02 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.259 -0.428 . . . . 71.019999999999996 110.894 179.914 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 69.6 p -107.74 163.26 13.25 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.184 -0.462 . . . . 72.540000000000006 111.146 179.959 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 14.2 m-20 -52.12 -40.87 61.96 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.219 -0.446 . . . . 53.409999999999997 110.844 179.913 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 59.7 tt0 -72.98 -33.52 65.88 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.185 -0.461 . . . . 74.129999999999995 110.898 -179.881 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -66.5 -44.33 82.85 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.109 -0.496 . . . . 73.549999999999997 110.904 -179.953 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 91.1 t -57.81 -31.07 39.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.152 -0.476 . . . . 73.420000000000002 111.08 -179.994 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 19.0 t0 -59.62 -45.39 92.08 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.235 -0.439 . . . . 74.140000000000001 110.859 179.928 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -55.81 -30.3 61.15 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.182 -0.463 . . . . 73.019999999999996 110.888 -179.909 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 4.3 mtt -76.01 -59.41 2.77 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.111 -0.495 . . . . 73.120000000000005 110.929 179.956 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 36.1 mm -53.99 -35.5 28.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.234 -0.439 . . . . 75.400000000000006 111.138 179.973 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 52.8 ttt85 -63.01 -31.79 73.01 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.178 -0.464 . . . . 75.25 110.875 179.944 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 31.7 tp10 -75.14 -52.44 10.99 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.164 -0.471 . . . . 72.319999999999993 110.895 -179.912 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -64.86 -34.47 78.46 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.149 -0.478 . . . . 75.129999999999995 111.119 179.889 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 48.7 t0 -68.46 86.93 0.3 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.219 -0.446 . . . . 74.329999999999998 110.861 -179.973 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 7.8 mt -79.97 -46.88 22.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.184 -0.462 . . . . 75.450000000000003 111.108 -179.984 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 21.1 p30 -72.47 -8.84 57.18 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.199 -0.455 . . . . 74.510000000000005 110.908 179.836 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 63.15 44.47 97.12 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.767 -0.73 . . . . 72.25 112.476 -179.97 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 35.5 p-10 -90.67 -15.95 29.45 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.86 0.362 . . . . 60.329999999999998 110.883 -179.948 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 102.79 3.02 49.54 Favored Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 120.75 -0.738 . . . . 73.420000000000002 112.492 -179.96 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 5.3 tt0 -149.27 172.3 15.09 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.824 0.345 . . . . 75.120000000000005 110.932 -179.925 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 136' ' ' VAL . . . . . . . . . . . . . 60.0 t -112.03 109.1 27.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.236 -0.438 . . . . 71.340000000000003 111.133 179.991 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 17.2 p30 -90.52 173.04 8.29 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.205 -0.452 . . . . 74.109999999999999 110.916 179.985 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 55.4 t80 -58.75 -47.44 84.64 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.213 -0.449 . . . . 72.140000000000001 110.94 -179.926 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 78.4 tt0 -51.89 -39.69 59.44 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.095 -0.502 . . . . 73.349999999999994 110.929 179.986 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 89.6 mt-10 -78.09 -38.31 44.45 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.135 -0.484 . . . . 73.239999999999995 110.876 -179.938 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 51.7 t80 -63.19 -35.55 80.69 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.195 -0.457 . . . . 74.420000000000002 110.841 -179.93 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 99.5 t -64.43 -44.43 97.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.149 -0.478 . . . . 75.150000000000006 111.138 -179.99 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 14.5 tt0 -74.03 -30.49 62.46 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.138 -0.483 . . . . 73.329999999999998 110.901 -179.993 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 6.9 tpt -73.1 -30.68 63.84 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.177 -0.465 . . . . 74.310000000000002 110.88 -179.999 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -82.48 -26.22 32.8 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.241 -0.436 . . . . 73.340000000000003 110.865 179.954 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 87.3 m . . . . . 0 C--N 1.329 -0.285 0 CA-C-N 116.217 -0.447 . . . . 73.439999999999998 111.172 -179.927 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' M' M ' 15' ' ' LYS . . . . . . . . . . . . . 12.8 mttm . . . . . 0 C--O 1.231 0.112 0 CA-C-O 120.792 0.329 . . . . 65.430000000000007 110.87 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' M' M ' 16' ' ' TRP . . . . . . . . . . . . . 7.8 m95 -51.79 -46.63 64.26 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.21 -0.45 . . . . 71.409999999999997 110.906 179.957 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' M' M ' 17' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -56.17 -28.44 58.1 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.262 -0.426 . . . . 74.140000000000001 110.882 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' M' M ' 18' ' ' LYS . . . . . . . . . . . . . 6.2 ttpm? -76.7 -26.01 54.24 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.15 -0.477 . . . . 74.540000000000006 110.883 179.98 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' M' M ' 19' ' ' ILE . . . . . . . . . . . . . 76.6 mt -79.35 -22.66 12.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.259 -0.428 . . . . 73.209999999999994 111.126 179.871 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' M' M ' 20' ' ' ARG . . . . . . . . . . . . . 47.7 ttp85 . . . . . 0 C--N 1.33 -0.281 0 CA-C-N 116.188 -0.46 . . . . 75.239999999999995 110.874 179.993 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' M' M ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.134 0 CA-C-O 120.788 0.327 . . . . 65.310000000000002 110.898 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' M' M ' 31' ' ' LEU . . . . . . . . . . . . . 19.6 tp -130.08 -44.33 1.16 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.24 -0.437 . . . . 74.400000000000006 110.905 179.899 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' M' M ' 32' ' ' LYS . . . . . . . . . . . . . 3.2 tttt -49.15 -43.71 42.02 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.201 -0.454 . . . . 73.540000000000006 110.925 179.849 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' M' M ' 33' ' ' HIS . . . . . . . . . . . . . 11.9 t60 -50.92 -39.01 53.63 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.227 -0.442 . . . . 72.230000000000004 110.841 179.853 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' M' M ' 34' ' ' ILE . . . . . . . . . . . . . 50.3 mm -51.26 -38.18 19.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.24 -0.436 . . . . 72.430000000000007 111.151 179.994 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' M' M ' 35' ' ' VAL . . . . . . . . . . . . . 44.1 t -48.88 -38.84 10.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.2 -0.454 . . . . 74.209999999999994 111.18 179.819 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' M' M ' 36' ' ' TRP . . . . . . . . . . . . . 20.1 m0 -58.46 -40.31 82.32 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.154 -0.475 . . . . 70.310000000000002 110.871 179.975 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' M' M ' 37' ' ' ALA . . . . . . . . . . . . . . . -63.89 -18.85 64.6 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.283 -0.417 . . . . 72.109999999999999 111.089 179.891 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' M' M ' 38' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -81.39 -17.79 47.76 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.215 -0.448 . . . . 75.030000000000001 110.882 -179.763 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' M' M ' 39' ' ' ARG . . . . . . . . . . . . . 20.3 ttt-85 -54.99 -26.63 38.12 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.129 -0.487 . . . . 74.099999999999994 110.906 -179.975 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' M' M ' 40' ' ' GLU . . . . . . . . . . . . . 71.9 mt-10 -87.35 -45.69 10.34 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.166 -0.47 . . . . 74.120000000000005 110.892 -179.948 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' M' M ' 41' ' ' LEU . . . . . . . . . . . . . 10.7 mt . . . . . 0 C--N 1.329 -0.313 0 CA-C-N 116.153 -0.476 . . . . 74.439999999999998 110.92 179.994 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 9.1 tp-100 . . . . . 0 C--O 1.231 0.089 0 CA-C-O 120.808 0.337 . . . . 74.519999999999996 110.92 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 59.5 mt -70.84 -45.48 73.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.161 -0.472 . . . . 72.140000000000001 111.125 179.969 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -54.73 -29.01 52.43 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.168 -0.469 . . . . 72.120000000000005 111.089 179.845 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 34.7 mm-40 -74.58 -52.23 12.37 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.212 -0.449 . . . . 71.340000000000003 110.915 -179.923 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 24.5 m-85 -63.05 -46.01 89.52 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.142 -0.481 . . . . 74.120000000000005 110.871 -179.924 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 2.5 tmtm? -54.69 -34.8 62.85 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.154 -0.475 . . . . 74.140000000000001 110.889 179.97 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 49.1 tt0 -64.91 -33.32 75.75 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.2 -0.455 . . . . 61.140000000000001 110.852 -179.994 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -66.8 -41.35 87.75 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.177 -0.465 . . . . 71.120000000000005 111.106 179.945 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 88.8 t80 -61.5 -54.28 45.29 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.194 -0.457 . . . . 74.329999999999998 110.877 -179.929 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 22.6 t -57.19 -26.45 60.66 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.15 -0.477 . . . . 62.100000000000001 110.858 -179.785 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 15.3 tp -66.85 -44.32 81.35 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.136 -0.484 . . . . 75.319999999999993 110.921 -179.955 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 36.8 m-85 -74.61 -30.79 61.79 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.166 -0.47 . . . . 73.200000000000003 110.876 179.924 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 17.9 t0 -72.73 98.69 2.44 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.114 -0.494 . . . . 63.43 110.878 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 19.3 mtpp -68.97 -53.3 21.41 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.147 -0.479 . . . . 75.439999999999998 110.93 179.961 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 20.8 p-10 -74.18 -10.47 59.64 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.184 -0.462 . . . . 71.519999999999996 110.856 179.876 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 50.94 43.6 49.19 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.719 -0.753 . . . . 72.430000000000007 112.504 -179.918 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 35.7 p-10 -88.04 -15.61 35.88 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.824 0.345 . . . . 54.509999999999998 110.856 -179.966 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 105.38 -11.58 47.38 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.727 -0.749 . . . . 63.130000000000003 112.511 -179.922 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 9.9 p -132.99 130.7 39.84 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.764 0.316 . . . . 74.129999999999995 111.13 -179.891 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 22.2 mt -86.6 122.7 39.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.203 -0.453 . . . . 72.409999999999997 111.168 179.898 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 81.6 p -98.28 176.94 5.53 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.199 -0.455 . . . . 74.129999999999995 111.14 179.98 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 62.4 p -65.22 -45.05 86.27 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.222 -0.445 . . . . 71.120000000000005 111.147 -179.98 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 21.2 mtmm -64.22 -42.83 96.4 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.219 -0.446 . . . . 75.239999999999995 110.858 179.91 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -67.48 -32.7 73.72 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.248 -0.433 . . . . 72.519999999999996 110.844 -179.992 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -68.35 -44.73 74.62 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.191 -0.459 . . . . 74.230000000000004 110.934 -179.95 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -71.76 -27.87 70.06 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.722 -0.752 . . . . 52.009999999999998 112.482 179.875 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 94.5 m -63.95 -54.22 37.96 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.808 0.337 . . . . 75.010000000000005 111.211 -179.889 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 47.2 t -58.18 -53.29 47.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.173 -0.467 . . . . 72.340000000000003 111.138 179.882 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 2.2 mtt -52.01 -36.61 50.52 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.181 -0.463 . . . . 75.420000000000002 110.856 179.938 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 34.5 ttt-85 -54.1 -46.7 72.15 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.204 -0.453 . . . . 74.409999999999997 110.859 -179.917 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 3.1 t -68.81 -26.2 65.06 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.201 -0.454 . . . . 74.319999999999993 110.892 -179.805 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 39.0 mt -82.73 -18.16 41.77 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.114 -0.494 . . . . 73.010000000000005 110.918 179.974 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 101.55 28.61 6.62 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.76 -0.733 . . . . 61.130000000000003 112.496 179.924 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 8.1 mm100 -116.7 123.26 46.79 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.801 0.334 . . . . 71.120000000000005 110.923 -179.89 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 32.5 t-20 -109.91 76.76 1.0 Allowed Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 121.638 0.732 . . . . 71.549999999999997 110.876 -179.929 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.7 168.06 22.58 Favored 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.672 2.248 . . . . 65.299999999999997 112.314 179.939 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 19.5 p -112.77 154.09 26.76 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.177 -0.465 . . . . 71.120000000000005 111.118 -179.951 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 12.3 tp10 -51.96 -38.81 57.88 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.23 -0.441 . . . . 73.549999999999997 110.831 -179.991 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.34 -31.5 64.01 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.167 -0.47 . . . . 74.310000000000002 111.05 179.974 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 21.4 tt0 -72.94 -52.7 13.57 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.246 -0.434 . . . . 75.340000000000003 110.893 -179.924 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 34.6 mt -56.07 -49.14 74.61 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.145 -0.48 . . . . 74.439999999999998 110.893 -179.942 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 12.8 tp60 -56.86 -29.01 62.51 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.207 -0.451 . . . . 72.5 110.923 179.909 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -75.5 -49.66 18.08 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.168 -0.469 . . . . 75.230000000000004 110.891 179.966 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 32.6 mtp -60.61 -54.84 40.54 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.211 -0.45 . . . . 72.129999999999995 110.895 179.956 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 65.9 mt -53.18 -42.83 47.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.264 -0.425 . . . . 65.109999999999999 111.123 179.934 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 76.0 m-20 -71.21 -27.09 63.24 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.204 -0.453 . . . . 61.329999999999998 110.865 179.974 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 10.8 tt0 -67.89 -28.95 67.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.195 -0.457 . . . . 73.319999999999993 110.893 179.994 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 3.4 m -112.03 16.92 7.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.155 -0.475 . . . . 62.219999999999999 111.133 179.951 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 28.8 t0 -88.89 99.55 12.49 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.198 -0.456 . . . . 73.439999999999998 110.854 179.908 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.3 -37.72 15.76 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.148 -0.478 . . . . 73.25 111.082 179.942 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -88.66 -0.32 57.17 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.222 -0.445 . . . . 62.399999999999999 110.866 179.981 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 51.37 57.89 10.93 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.746 -0.74 . . . . 70.129999999999995 112.466 -179.963 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 48.8 p-10 -114.56 -15.73 11.97 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.884 0.373 . . . . 73.150000000000006 110.894 -179.896 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 89.84 19.22 48.48 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.777 -0.725 . . . . 53.509999999999998 112.546 179.985 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 44.3 p -148.34 168.28 23.02 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.764 0.316 . . . . 74.340000000000003 111.144 -179.885 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 13.3 mm -100.93 109.48 25.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.214 -0.448 . . . . 74.140000000000001 111.15 179.894 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -76.2 -173.49 2.43 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.193 -0.458 . . . . 73.530000000000001 110.848 179.902 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.51 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 2.5 t80 -64.57 -58.51 13.27 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-O 121.651 0.738 . . . . 74.329999999999998 110.861 -179.895 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . 0.51 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 54.5 Cg_endo -69.69 -30.34 22.77 Favored 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 122.699 2.266 . . . . 65.310000000000002 112.38 179.981 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 18.1 mt-10 -57.17 -40.78 77.99 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.221 -0.445 . . . . 74.25 110.847 -179.957 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 12.5 t80 -74.11 -36.1 64.2 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.143 -0.48 . . . . 72.120000000000005 110.898 -179.918 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 29.0 tp -67.28 -53.74 27.14 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.137 -0.483 . . . . 75.120000000000005 110.935 -179.942 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 12.6 t -53.13 -27.56 21.43 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.173 -0.467 . . . . 73.310000000000002 111.101 179.941 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 56.1 ttp -67.51 -42.72 82.35 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.24 -0.436 . . . . 74.310000000000002 110.891 179.919 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 2.7 mtt -79.82 -31.71 40.62 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.214 -0.448 . . . . 71.030000000000001 110.863 179.998 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.266 0 CA-C-N 116.23 -0.441 . . . . 64.230000000000004 111.103 179.877 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 58.2 mt . . . . . 0 C--O 1.231 0.109 0 CA-C-O 120.823 0.344 . . . . 75.319999999999993 111.135 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 13.5 ttt85 -61.7 -28.21 69.25 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.157 -0.474 . . . . 74.219999999999999 110.887 179.982 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 17.5 tt0 -67.36 -58.01 5.58 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.199 -0.455 . . . . 75.030000000000001 110.886 -179.941 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -59.52 -47.38 85.76 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.196 -0.457 . . . . 54.310000000000002 111.086 179.927 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -52.03 -43.89 63.95 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.181 -0.463 . . . . 74.530000000000001 110.866 -179.878 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 60.8 ttt180 -69.53 -32.19 70.87 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.135 -0.484 . . . . 73.319999999999993 110.899 -179.917 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 90.8 t -68.5 -27.76 37.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.172 -0.467 . . . . 72.409999999999997 111.13 179.957 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 9.1 m-85 -93.68 -33.33 13.69 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.198 -0.455 . . . . 74.519999999999996 110.904 179.994 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 25.8 t0 -64.25 96.75 0.16 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.159 -0.473 . . . . 75.209999999999994 110.874 179.965 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 7.4 tppt? -78.72 -53.21 7.38 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.16 -0.473 . . . . 75.200000000000003 110.914 -179.992 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 56.4 p-10 -72.85 -9.07 58.26 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.249 -0.432 . . . . 75.510000000000005 110.891 179.848 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 59.63 26.68 62.73 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.772 -0.727 . . . . 63.450000000000003 112.448 -179.981 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 39.3 p-10 -81.8 -16.14 51.91 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.869 0.366 . . . . 63.420000000000002 110.895 -179.864 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 88.48 18.72 54.53 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.727 -0.749 . . . . 74.299999999999997 112.441 179.946 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 19.0 m-85 -140.52 150.19 43.41 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.889 0.376 . . . . 74.310000000000002 110.944 -179.823 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 62.3 mt -120.98 133.48 67.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.111 -0.495 . . . . 71.109999999999999 111.157 179.907 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 97.8 p -114.44 177.74 4.53 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.174 -0.466 . . . . 72.540000000000006 110.897 -179.896 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -60.66 -34.54 74.45 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.201 -0.454 . . . . 72.099999999999994 111.081 179.927 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -71.9 -49.33 38.78 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.279 -0.419 . . . . 73.120000000000005 111.093 179.966 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 17.4 mt-10 -63.01 -46.52 87.27 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.202 -0.454 . . . . 72.150000000000006 110.893 -179.922 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 26.4 tp -52.98 -42.7 65.79 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.137 -0.483 . . . . 74.099999999999994 110.887 -179.977 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 5.9 ttt-85 -62.13 -34.95 77.33 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.219 -0.446 . . . . 74.400000000000006 110.873 179.952 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 16.5 t60 -58.52 -34.9 71.48 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.175 -0.466 . . . . 74.439999999999998 110.871 179.998 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 58.0 t -70.99 -39.17 74.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.242 -0.435 . . . . 71.109999999999999 111.084 -179.99 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 5.1 mmt -76.43 -26.67 55.73 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.229 -0.441 . . . . 75.540000000000006 110.885 179.917 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 40.4 m -71.66 -56.04 6.57 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.221 -0.445 . . . . 74.239999999999995 111.164 -179.952 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -56.09 -31.16 62.99 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.219 -0.446 . . . . 72.120000000000005 110.921 179.956 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 3.2 mt -71.46 -25.86 62.47 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.137 -0.483 . . . . 73.439999999999998 110.931 179.982 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 100.95 33.01 5.13 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.777 -0.725 . . . . 74.25 112.508 179.933 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 29.6 tp10 -110.08 110.18 20.98 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.932 0.396 . . . . 75.230000000000004 110.875 -179.896 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 30.9 mttm -60.79 102.68 0.2 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.124 -0.489 . . . . 74.219999999999999 110.894 179.984 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 81.1 mt -138.95 146.76 41.39 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.222 -0.445 . . . . 72.230000000000004 110.937 179.893 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 41.8 p -112.62 175.12 5.57 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.185 -0.461 . . . . 72.209999999999994 111.131 179.934 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -57.1 -45.05 83.71 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.175 -0.466 . . . . 73.230000000000004 110.877 179.882 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 13.6 tp10 -62.55 -33.64 75.33 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.174 -0.466 . . . . 73.430000000000007 110.871 -179.898 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 18.5 tt0 -73.84 -31.4 63.18 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.184 -0.462 . . . . 75.209999999999994 110.91 -179.942 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 65.0 t -72.5 -30.72 35.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.135 -0.484 . . . . 72.349999999999994 111.083 -179.986 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -51.94 -47.24 64.8 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.193 -0.458 . . . . 74.430000000000007 110.86 179.928 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 13.0 tp10 -56.79 -29.51 62.75 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.201 -0.454 . . . . 73.109999999999999 110.917 -179.917 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 17.2 mtp -73.96 -59.01 2.92 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.129 -0.487 . . . . 72.400000000000006 110.898 179.973 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 35.4 mm -53.93 -35.76 28.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.211 -0.45 . . . . 74.519999999999996 111.161 179.926 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 63.8 ttt180 -65.13 -31.83 73.22 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.15 -0.477 . . . . 74.5 110.888 179.944 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -72.46 -50.2 27.82 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.158 -0.474 . . . . 73.340000000000003 110.871 -179.931 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -69.36 -34.01 73.94 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.204 -0.453 . . . . 74.319999999999993 111.064 179.961 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 50.3 t0 -68.41 86.6 0.29 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.229 -0.442 . . . . 75.030000000000001 110.818 -179.984 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 60.0 mt -79.93 -45.56 22.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.221 -0.445 . . . . 74.510000000000005 111.091 179.969 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 22.6 p30 -72.73 -8.79 57.12 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.192 -0.458 . . . . 73.329999999999998 110.827 179.928 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 62.77 43.34 99.1 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.717 -0.754 . . . . 50.329999999999998 112.512 -179.932 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 32.5 p-10 -88.69 -16.02 33.38 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.902 0.382 . . . . 53.420000000000002 110.888 -179.944 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 103.37 2.94 47.67 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.691 -0.766 . . . . 73.439999999999998 112.482 -179.936 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 5.1 tt0 -149.25 172.26 15.15 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.799 0.333 . . . . 73.019999999999996 110.898 -179.861 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 136' ' ' VAL . . . . . . . . . . . . . 96.1 t -109.89 118.69 57.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.181 -0.463 . . . . 74.519999999999996 111.143 179.963 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 44.2 p-10 -102.16 166.85 10.37 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.204 -0.453 . . . . 74.349999999999994 110.928 179.989 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 48.0 t80 -51.9 -45.62 64.26 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.206 -0.452 . . . . 72.340000000000003 110.913 -179.893 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 6.1 tm-20 -53.4 -40.61 65.19 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.122 -0.49 . . . . 74.400000000000006 110.833 -179.941 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 17.5 mt-10 -78.43 -34.5 47.82 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.154 -0.476 . . . . 74.019999999999996 110.906 -179.91 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 41.1 t80 -67.15 -35.41 79.64 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.184 -0.462 . . . . 72.319999999999993 110.856 -179.925 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 97.8 t -64.67 -44.04 96.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.179 -0.464 . . . . 71.319999999999993 111.105 -179.998 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 48.6 tt0 -74.23 -23.84 59.23 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.214 -0.448 . . . . 73.230000000000004 110.88 -179.954 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 8.7 tpt -74.99 -18.85 60.3 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.169 -0.469 . . . . 71.120000000000005 110.911 179.97 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 9.2 ttm -98.23 -30.75 12.44 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.22 -0.445 . . . . 75.439999999999998 110.884 179.971 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 4.7 t . . . . . 0 C--N 1.329 -0.296 0 CA-C-N 116.236 -0.438 . . . . 75.430000000000007 111.174 -179.993 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' M' M ' 15' ' ' LYS . . . . . . . . . . . . . 40.5 mttp . . . . . 0 C--O 1.231 0.122 0 CA-C-O 120.754 0.312 . . . . 72.120000000000005 110.875 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' M' M ' 16' ' ' TRP . . . . . . . . . . . . . 24.2 m95 -53.77 -34.5 59.21 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.278 -0.419 . . . . 73.209999999999994 110.926 179.964 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' M' M ' 17' ' ' GLU . . . . . . . . . . . . . 5.3 tm-20 -58.67 -25.91 63.27 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.229 -0.441 . . . . 73.010000000000005 110.884 179.997 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' M' M ' 18' ' ' LYS . . . . . . . . . . . . . 16.0 ttpp -67.66 -26.85 66.41 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.185 -0.461 . . . . 74.519999999999996 110.91 179.951 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' M' M ' 19' ' ' ILE . . . . . . . . . . . . . 28.2 mt -92.61 -22.81 5.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.215 -0.448 . . . . 73.099999999999994 111.13 179.879 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' M' M ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.294 0 CA-C-N 116.165 -0.471 . . . . 73.129999999999995 110.856 179.983 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' M' M ' 30' ' ' LYS . . . . . . . . . . . . . 2.1 mtpp . . . . . 0 C--O 1.232 0.164 0 CA-C-O 120.755 0.312 . . . . 71.349999999999994 110.887 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' M' M ' 31' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -82.89 -21.16 34.34 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.209 -0.45 . . . . 75.519999999999996 110.902 179.93 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' M' M ' 32' ' ' LYS . . . . . . . . . . . . . 25.1 ttpp -48.04 -48.61 32.99 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.198 -0.455 . . . . 73.209999999999994 110.93 179.813 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' M' M ' 33' ' ' HIS . . . . . . . . . . . . . 11.1 t-80 -52.01 -37.5 53.5 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.233 -0.439 . . . . 75.510000000000005 110.846 179.87 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' M' M ' 34' ' ' ILE . . . . . . . . . . . . . 36.3 mm -51.66 -37.19 19.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.184 -0.462 . . . . 73.400000000000006 111.108 -179.991 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' M' M ' 35' ' ' VAL . . . . . . . . . . . . . 46.3 t -49.48 -38.45 12.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.207 -0.451 . . . . 74.299999999999997 111.126 179.862 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' M' M ' 36' ' ' TRP . . . . . . . . . . . . . 16.9 m0 -58.6 -39.52 80.63 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.19 -0.459 . . . . 74.099999999999994 110.919 179.999 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' M' M ' 37' ' ' ALA . . . . . . . . . . . . . . . -63.44 -18.7 64.02 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.193 -0.458 . . . . 60.130000000000003 111.096 179.905 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' M' M ' 38' ' ' SER . . . . . . . . . . . . . 1.1 m -70.62 -18.03 62.87 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.18 -0.464 . . . . 72.219999999999999 110.908 -179.798 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' M' M ' 39' ' ' ARG . . . . . . . . . . . . . 8.7 mmm180 -61.48 -25.14 67.05 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.118 -0.492 . . . . 75.040000000000006 110.92 -179.963 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' M' M ' 40' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -85.51 -47.97 9.4 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.143 -0.48 . . . . 74.230000000000004 110.851 -179.904 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' M' M ' 41' ' ' LEU . . . . . . . . . . . . . 12.0 mt . . . . . 0 C--N 1.329 -0.306 0 CA-C-N 116.191 -0.458 . . . . 74.030000000000001 110.882 -179.933 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.119 0 CA-C-O 120.876 0.37 . . . . 71.140000000000001 111.115 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 57.89 71.52 0.57 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.188 -0.46 . . . . 74.319999999999993 110.884 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 15.4 pt20 -165.33 171.63 13.27 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.125 -0.489 . . . . 72.010000000000005 110.923 -179.902 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 9.5 mt -118.2 141.6 48.33 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.221 -0.445 . . . . 75.129999999999995 110.871 -179.935 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 30.0 p -117.72 174.57 6.09 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.174 -0.466 . . . . 73.140000000000001 111.087 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 70.9 tt0 -53.33 -29.24 32.82 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.183 -0.462 . . . . 62.43 110.88 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -68.12 -41.06 82.3 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.199 -0.455 . . . . 74.409999999999997 110.85 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 35.4 tp60 -77.92 -37.79 47.0 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.146 -0.479 . . . . 74.299999999999997 110.898 -179.932 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 69.3 mt -71.72 -37.44 62.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.209 -0.45 . . . . 75.129999999999995 111.133 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -52.18 -32.92 38.4 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.158 -0.474 . . . . 61.149999999999999 111.087 179.796 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 -74.82 -52.1 12.28 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.231 -0.441 . . . . 73.510000000000005 110.893 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 50.1 m-85 -58.34 -46.0 87.07 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.181 -0.463 . . . . 73.209999999999994 110.843 -179.901 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.0 ttpt -54.89 -29.57 56.11 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.124 -0.489 . . . . 74.5 110.929 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -71.18 -30.76 66.82 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.198 -0.456 . . . . 71.019999999999996 110.932 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -64.96 -42.61 94.45 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.157 -0.474 . . . . 72.109999999999999 111.107 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 48.5 t80 -55.41 -54.21 46.62 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.168 -0.469 . . . . 71.549999999999997 110.898 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 36.5 t -51.99 -36.64 50.4 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.112 -0.495 . . . . 71.319999999999993 110.871 -179.812 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 17.7 tp -59.73 -41.62 91.32 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.15 -0.477 . . . . 71.409999999999997 110.897 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 33.9 m-85 -82.59 -25.87 32.85 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.227 -0.442 . . . . 74.310000000000002 110.852 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 11.1 t0 -86.69 98.53 11.18 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.179 -0.464 . . . . 65.530000000000001 110.89 179.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 70.4 mmtt -72.57 -56.85 4.71 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.166 -0.47 . . . . 73.549999999999997 110.894 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 27.1 p-10 -72.84 -10.09 59.4 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.206 -0.452 . . . . 71.299999999999997 110.835 179.922 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 52.05 49.08 50.74 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.759 -0.734 . . . . 73.5 112.465 -179.935 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 31.1 p-10 -88.53 -15.62 34.76 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.855 0.359 . . . . 71.340000000000003 110.871 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 105.31 -11.68 47.69 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.748 -0.739 . . . . 73.400000000000006 112.521 -179.912 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 49.0 p -135.21 130.69 35.66 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.75 0.31 . . . . 73.200000000000003 111.146 -179.879 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 24.7 mt -88.14 126.44 41.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.206 -0.452 . . . . 75.150000000000006 111.109 179.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 60.4 p -110.33 176.2 5.14 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.187 -0.46 . . . . 65.230000000000004 111.143 179.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 21.7 p -64.12 -32.88 74.61 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.242 -0.435 . . . . 71.310000000000002 111.128 -179.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 43.5 mtpt -69.72 -43.53 72.16 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.204 -0.453 . . . . 72.019999999999996 110.932 179.901 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -75.21 -33.74 61.42 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.224 -0.444 . . . . 75.120000000000005 110.903 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.1 tt -74.28 -54.9 6.73 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.132 -0.485 . . . . 74.409999999999997 110.918 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -52.17 -28.53 26.56 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.739 -0.743 . . . . 73.400000000000006 112.467 179.91 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 94.9 m -70.84 -54.83 10.12 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.865 0.364 . . . . 72.439999999999998 111.17 -179.864 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 97.6 t -56.39 -46.67 82.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.171 -0.468 . . . . 75.329999999999998 111.122 179.9 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 31.3 mtp -55.96 -31.57 63.09 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.171 -0.468 . . . . 74.200000000000003 110.838 179.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 12.6 tpt180 -59.83 -53.32 59.28 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.265 -0.425 . . . . 75.310000000000002 110.863 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 2.2 t -61.87 -26.6 68.24 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.185 -0.462 . . . . 71.319999999999993 110.869 -179.775 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 53.8 mt -77.96 -24.62 48.08 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.126 -0.488 . . . . 72.120000000000005 110.948 179.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 100.84 33.08 5.13 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.755 -0.736 . . . . 70.420000000000002 112.451 179.88 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 5.0 tp-100 -130.86 105.82 8.02 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.805 0.336 . . . . 74.540000000000006 110.877 -179.902 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 59.1 t30 -109.92 76.75 1.0 Allowed Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.643 0.735 . . . . 75.329999999999998 110.923 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.75 167.97 22.9 Favored 'Trans proline' 0 C--O 1.232 0.186 0 C-N-CA 122.685 2.256 . . . . 74.450000000000003 112.359 179.933 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 69.7 p -81.62 159.95 23.9 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.199 -0.455 . . . . 63.240000000000002 111.179 -179.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -52.06 -40.45 61.17 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.253 -0.431 . . . . 71.140000000000001 110.858 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.17 -31.48 64.25 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.194 -0.457 . . . . 75.319999999999993 111.081 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 27.1 tt0 -69.73 -45.94 67.01 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.223 -0.444 . . . . 75.329999999999998 110.891 -179.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 29.2 mt -55.33 -51.61 66.18 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.152 -0.476 . . . . 62.43 110.919 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 14.7 tp60 -59.7 -28.98 67.78 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.183 -0.462 . . . . 73.329999999999998 110.885 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -70.28 -49.57 48.41 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.224 -0.443 . . . . 75.299999999999997 110.871 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 7.5 mtp -55.46 -52.65 62.92 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.204 -0.453 . . . . 75.310000000000002 110.863 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 62.8 mt -64.4 -37.72 80.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.257 -0.429 . . . . 74.0 111.128 179.941 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 19.4 m-20 -57.28 -41.74 80.35 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.195 -0.457 . . . . 73.319999999999993 110.912 179.907 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 16.3 mm-40 -53.13 -52.75 57.69 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.167 -0.469 . . . . 74.109999999999999 110.92 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 16.5 m -76.02 -19.26 15.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.155 -0.475 . . . . 75.049999999999997 111.126 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 38.8 t0 -66.86 95.98 0.39 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.165 -0.47 . . . . 51.439999999999998 110.856 179.931 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.21 -42.0 12.59 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.125 -0.488 . . . . 74.340000000000003 111.091 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -82.2 -0.15 43.76 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.245 -0.434 . . . . 75.510000000000005 110.864 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 53.62 60.86 7.67 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.763 -0.732 . . . . 72.329999999999998 112.489 -179.933 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 52.3 p-10 -114.49 -15.81 12.0 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.876 0.37 . . . . 73.150000000000006 110.889 -179.893 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 89.59 19.65 47.69 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.773 -0.727 . . . . 63.420000000000002 112.513 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 33.4 p -152.07 156.78 40.59 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.763 0.316 . . . . 62.439999999999998 111.148 -179.829 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 18.4 mt -93.37 111.04 24.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.209 -0.451 . . . . 74.430000000000007 111.123 179.921 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -75.72 -172.91 2.03 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.154 -0.475 . . . . 73.230000000000004 110.842 179.862 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.52 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 2.4 t80 -65.43 -58.28 12.42 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.633 0.73 . . . . 75.329999999999998 110.849 -179.855 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . 0.52 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 54.0 Cg_endo -69.7 -26.84 27.46 Favored 'Trans proline' 0 C--N 1.342 0.201 0 C-N-CA 122.64 2.227 . . . . 62.439999999999998 112.385 179.987 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 22.9 mt-10 -62.59 -39.99 95.49 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.21 -0.45 . . . . 72.439999999999998 110.872 -179.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 13.2 t80 -74.71 -35.71 62.7 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.14 -0.482 . . . . 73.010000000000005 110.882 -179.896 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 39.8 tp -70.56 -54.2 13.03 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.16 -0.473 . . . . 72.430000000000007 110.896 180.0 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 14.2 t -51.63 -30.4 21.31 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.165 -0.47 . . . . 71.540000000000006 111.176 179.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 37.3 ttp -59.71 -49.94 75.79 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.194 -0.457 . . . . 74.099999999999994 110.899 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 3.1 mmt -70.83 -25.81 63.01 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.184 -0.462 . . . . 75.040000000000006 110.872 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -72.01 -34.58 68.97 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.212 -0.449 . . . . 73.209999999999994 111.132 179.902 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 19.5 ttm-85 -57.16 -24.2 52.65 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.216 -0.447 . . . . 74.340000000000003 110.85 -179.912 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.3 -28.27 27.28 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.213 -0.449 . . . . 73.310000000000002 110.907 179.967 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -51.89 -61.95 1.94 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.209 -0.45 . . . . 75.349999999999994 110.852 179.864 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 31.5 mmtp -152.19 -177.95 6.5 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.218 -0.446 . . . . 74.549999999999997 110.906 -179.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 21.7 m-20 63.29 162.34 0.1 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.241 -0.436 . . . . 75.409999999999997 110.863 179.84 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 94.6 m 60.11 85.97 0.1 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.221 -0.445 . . . . 73.340000000000003 111.148 -179.901 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -146.25 -42.58 0.2 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.209 -0.451 . . . . 65.340000000000003 110.852 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 3.8 p -52.01 -31.0 27.78 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.151 -0.477 . . . . 72.120000000000005 110.84 -179.795 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -58.67 -43.3 89.84 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.129 -0.487 . . . . 75.219999999999999 110.889 -179.917 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -57.08 -42.11 80.07 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.127 -0.488 . . . . 73.140000000000001 110.883 -179.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 42.1 mm-40 -60.61 -26.67 67.17 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.153 -0.476 . . . . 63.409999999999997 110.903 -179.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 65.3 mt -73.99 -45.36 48.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.165 -0.47 . . . . 72.0 111.142 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.449 ' NE ' ' HZ2' ' M' ' 30' ' ' LYS . 34.2 ttt-85 -71.24 -45.41 63.33 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.195 -0.457 . . . . 72.510000000000005 110.841 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -60.65 -53.77 53.38 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.222 -0.445 . . . . 74.420000000000002 110.893 -179.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -53.45 -47.85 69.34 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.183 -0.462 . . . . 61.039999999999999 111.088 179.896 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 3.0 t80 -52.09 -46.87 65.41 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.22 -0.446 . . . . 73.109999999999999 110.865 -179.899 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 22.5 ttm-85 -69.07 -31.71 70.66 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.154 -0.475 . . . . 75.329999999999998 110.863 -179.919 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 92.5 t -68.92 -27.34 35.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.163 -0.471 . . . . 74.519999999999996 111.121 -179.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 17.9 m-85 -96.35 -26.59 15.31 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.183 -0.462 . . . . 73.129999999999995 110.899 179.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 29.6 t0 -69.48 94.57 0.76 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.141 -0.481 . . . . 71.530000000000001 110.913 179.922 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 9.7 ttmm -78.47 -52.82 7.97 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.223 -0.444 . . . . 74.25 110.895 -179.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 50.3 p30 -72.52 -9.14 58.2 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.176 -0.466 . . . . 71.129999999999995 110.789 179.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 60.17 27.64 65.43 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.77 -0.729 . . . . 75.219999999999999 112.464 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 39.6 p-10 -82.85 -16.22 48.5 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.879 0.371 . . . . 72.329999999999998 110.901 -179.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 86.47 18.67 58.35 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.748 -0.739 . . . . 70.349999999999994 112.473 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 12.4 m-85 -140.47 145.37 36.85 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.852 0.358 . . . . 73.209999999999994 110.929 -179.819 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 66.7 mt -111.5 127.02 68.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.119 -0.492 . . . . 75.310000000000002 111.13 179.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 26.4 p -117.0 174.67 5.97 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.155 -0.475 . . . . 74.409999999999997 110.853 -179.893 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -60.03 -30.02 68.9 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.15 -0.477 . . . . 72.140000000000001 111.113 179.912 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -69.93 -46.12 66.03 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.215 -0.448 . . . . 73.219999999999999 111.089 179.931 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 55.5 mt-10 -72.5 -46.61 53.89 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.218 -0.446 . . . . 75.120000000000005 110.881 -179.893 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 44.1 tp -55.84 -46.54 78.15 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.187 -0.461 . . . . 75.109999999999999 110.951 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 56.8 ttp85 -58.31 -33.76 69.84 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.168 -0.469 . . . . 72.019999999999996 110.9 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 79.6 t60 -72.18 -36.4 69.25 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.176 -0.465 . . . . 74.450000000000003 110.836 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 83.8 t -66.78 -40.82 86.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.2 -0.454 . . . . 74.200000000000003 111.124 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 11.2 mmt -64.15 -27.9 69.39 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.183 -0.462 . . . . 74.209999999999994 110.883 179.91 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 1.5 m -66.08 -42.0 89.95 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.244 -0.435 . . . . 75.099999999999994 111.145 -179.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 33.4 t30 -58.63 -34.3 71.02 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.283 -0.417 . . . . 74.549999999999997 110.922 179.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 18.0 mt -73.25 -26.22 61.02 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.158 -0.474 . . . . 74.530000000000001 110.918 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 100.48 31.1 5.94 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.723 -0.751 . . . . 64.540000000000006 112.508 179.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -108.73 114.68 28.67 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.903 0.382 . . . . 74.310000000000002 110.88 -179.855 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.4 102.03 2.09 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.116 -0.493 . . . . 74.450000000000003 110.899 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 11.1 mt -133.21 146.81 51.82 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.215 -0.448 . . . . 75.329999999999998 110.894 179.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 29.2 p -108.51 -175.39 2.76 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.141 -0.481 . . . . 63.039999999999999 111.115 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 72.6 m-20 -65.57 -38.91 90.92 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.169 -0.468 . . . . 73.239999999999995 110.878 179.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -65.43 -33.47 76.03 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.176 -0.465 . . . . 73.109999999999999 110.93 -179.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 19.0 tt0 -72.11 -49.8 33.28 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.12 -0.491 . . . . 72.530000000000001 110.905 -179.909 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 58.3 t -54.45 -31.16 22.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.175 -0.466 . . . . 75.239999999999995 111.131 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -51.94 -42.7 63.04 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.193 -0.458 . . . . 52.219999999999999 110.879 179.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 11.4 tp10 -62.94 -31.4 72.48 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.164 -0.471 . . . . 74.430000000000007 110.905 -179.909 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 94.8 mtp -72.99 -59.47 2.69 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.098 -0.501 . . . . 74.310000000000002 110.869 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 35.9 mm -53.99 -35.59 28.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.208 -0.451 . . . . 75.310000000000002 111.146 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 39.1 ttt85 -63.33 -31.9 73.18 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.199 -0.455 . . . . 73.140000000000001 110.898 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 19.3 tp10 -74.85 -52.37 11.52 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.137 -0.483 . . . . 75.420000000000002 110.871 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -65.11 -34.43 78.38 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.185 -0.461 . . . . 63.43 111.102 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 49.4 t0 -68.4 86.77 0.29 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.167 -0.47 . . . . 75.099999999999994 110.862 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 58.0 mt -79.83 -46.23 22.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.184 -0.462 . . . . 74.109999999999999 111.085 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 21.2 p30 -72.76 -8.67 56.58 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.176 -0.465 . . . . 62.450000000000003 110.84 179.89 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 62.71 42.99 99.61 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.745 -0.741 . . . . 55.43 112.5 -179.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 34.8 p-10 -88.08 -15.95 34.86 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.881 0.372 . . . . 75.140000000000001 110.89 -179.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 104.1 2.36 45.16 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.733 -0.746 . . . . 60.049999999999997 112.496 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 5.6 tt0 -149.19 172.24 15.15 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.858 0.361 . . . . 74.329999999999998 110.906 -179.85 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 136' ' ' VAL . . . . . . . . . . . . . 94.6 t -107.51 111.31 35.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.233 -0.44 . . . . 75.030000000000001 111.125 179.935 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 44.0 p-10 -92.5 166.13 12.68 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.136 -0.484 . . . . 73.430000000000007 110.934 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 78.1 t80 -51.96 -46.72 64.89 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.203 -0.453 . . . . 75.129999999999995 110.961 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -51.98 -41.04 61.84 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.092 -0.504 . . . . 75.349999999999994 110.913 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -78.44 -36.26 45.7 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.14 -0.482 . . . . 75.140000000000001 110.873 -179.92 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 66.0 t80 -64.67 -35.51 81.27 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.136 -0.484 . . . . 74.109999999999999 110.87 -179.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 94.4 t -69.77 -38.5 76.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.169 -0.468 . . . . 64.140000000000001 111.094 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 45.0 tt0 -71.37 -36.56 71.49 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.19 -0.459 . . . . 73.200000000000003 110.926 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 5.7 tpt -72.81 -29.16 63.03 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.194 -0.457 . . . . 74.340000000000003 110.881 179.969 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -84.32 -27.91 27.45 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.24 -0.436 . . . . 74.049999999999997 110.846 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 87.6 m -86.75 -30.19 21.79 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.231 -0.44 . . . . 73.530000000000001 111.108 -179.898 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -101.1 172.71 6.84 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.225 -0.443 . . . . 65.239999999999995 111.078 179.917 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 86.0 tttt . . . . . 0 C--N 1.328 -0.337 0 CA-C-N 116.218 -0.446 . . . . 72.409999999999997 110.904 179.965 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' M' M ' 8' ' ' LEU . . . . . . . . . . . . . 4.3 mm? . . . . . 0 C--O 1.231 0.092 0 CA-C-O 120.841 0.353 . . . . 74.329999999999998 110.903 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' M' M ' 9' ' ' SER . . . . . . . . . . . . . 9.4 p -114.45 -61.57 1.73 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.167 -0.47 . . . . 73.230000000000004 110.871 -179.932 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' M' M ' 10' ' ' GLY . . . . . . . . . . . . . . . 177.58 176.25 45.47 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.744 -0.741 . . . . 65.120000000000005 112.461 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' M' M ' 11' ' ' GLY . . . . . . . . . . . . . . . 161.56 -105.23 0.25 Allowed Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.72 -0.752 . . . . 73.150000000000006 112.479 -179.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' M' M ' 12' ' ' GLU . . . . . . . . . . . . . 1.1 pm0 -111.15 177.9 4.51 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.864 0.364 . . . . 73.530000000000001 110.876 -179.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' M' M ' 13' ' ' LEU . . . . . . . . . . . . . 10.1 tt -65.04 98.19 0.28 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.162 -0.472 . . . . 74.109999999999999 110.923 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' M' M ' 14' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -103.1 25.78 9.04 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.199 -0.455 . . . . 63.049999999999997 110.854 179.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' M' M ' 15' ' ' LYS . . . . . . . . . . . . . 20.0 mttm -79.13 -44.51 21.84 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.197 -0.456 . . . . 74.430000000000007 110.871 179.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' M' M ' 16' ' ' TRP . . . . . . . . . . . . . 7.2 m95 -52.1 -45.9 65.05 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.257 -0.429 . . . . 75.450000000000003 110.931 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' M' M ' 17' ' ' GLU . . . . . . . . . . . . . 15.8 tm-20 -57.52 -27.2 62.38 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.211 -0.449 . . . . 71.25 110.897 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' M' M ' 18' ' ' LYS . . . . . . . . . . . . . 8.9 ttmm -69.93 -27.6 64.9 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.158 -0.473 . . . . 74.510000000000005 110.859 179.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' M' M ' 19' ' ' ILE . . . . . . . . . . . . . 34.3 mt -83.09 -25.22 8.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.245 -0.434 . . . . 75.340000000000003 111.146 179.863 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' M' M ' 20' ' ' ARG . . . . . . . . . . . . . 22.7 ttp180 -71.27 -26.16 62.76 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.171 -0.468 . . . . 75.329999999999998 110.853 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' M' M ' 21' ' ' LEU . . . . . . . . . . . . . 9.9 mt 62.98 -176.83 0.15 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.223 -0.444 . . . . 73.340000000000003 110.898 -179.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' M' M ' 22' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -82.83 158.56 64.94 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.628 0.728 . . . . 65.219999999999999 110.866 179.979 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' M' M ' 23' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.71 124.06 10.73 Favored 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.718 2.278 . . . . 71.0 112.354 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' M' M ' 24' ' ' GLY . . . . . . . . . . . . . . . 146.19 138.36 3.19 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.737 -0.744 . . . . 73.109999999999999 112.462 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' M' M ' 25' ' ' GLY . . . . . . . . . . . . . . . 175.86 -169.57 42.28 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.774 -0.727 . . . . 73.310000000000002 112.512 -179.911 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' M' M ' 26' ' ' LYS . . . . . . . . . . . . . 4.6 mmmm -85.55 160.7 19.59 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.845 0.355 . . . . 74.430000000000007 110.912 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' M' M ' 27' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.99 142.03 35.51 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.241 -0.436 . . . . 65.219999999999999 110.868 179.899 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' M' M ' 28' ' ' GLN . . . . . . . . . . . . . 4.4 tm0? -166.45 135.27 2.96 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.243 -0.435 . . . . 74.430000000000007 110.923 179.933 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' M' M ' 29' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -97.01 158.59 15.35 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.261 -0.427 . . . . 75.219999999999999 110.941 -179.881 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' M' M ' 30' ' ' LYS . . . . . 0.449 ' HZ2' ' NE ' ' A' ' 86' ' ' ARG . 17.8 tptt -92.99 44.78 1.16 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.094 -0.503 . . . . 75.040000000000006 110.946 179.906 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' M' M ' 31' ' ' LEU . . . . . . . . . . . . . 18.9 tp -179.76 -39.07 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.212 -0.449 . . . . 73.310000000000002 110.896 179.912 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' M' M ' 32' ' ' LYS . . . . . . . . . . . . . 1.6 tmtt? -50.26 -40.95 49.52 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.23 -0.441 . . . . 74.409999999999997 110.907 179.849 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' M' M ' 33' ' ' HIS . . . . . . . . . . . . . 83.9 t60 -50.25 -38.68 41.99 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.23 -0.441 . . . . 73.340000000000003 110.894 179.842 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' M' M ' 34' ' ' ILE . . . . . . . . . . . . . 48.8 mm -50.13 -39.77 16.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.2 -0.455 . . . . 73.519999999999996 111.102 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' M' M ' 35' ' ' VAL . . . . . . . . . . . . . 97.0 t -49.16 -40.18 13.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.228 -0.442 . . . . 74.120000000000005 111.1 179.869 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' M' M ' 36' ' ' TRP . . . . . . . . . . . . . 24.7 m0 -58.57 -39.67 80.98 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.196 -0.456 . . . . 73.299999999999997 110.906 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' M' M ' 37' ' ' ALA . . . . . . . . . . . . . . . -63.99 -18.69 64.54 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.25 -0.432 . . . . 72.319999999999993 111.095 179.864 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' M' M ' 38' ' ' SER . . . . . . . . . . . . . 1.6 m -71.94 -17.93 62.05 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.278 -0.419 . . . . 64.049999999999997 110.876 -179.808 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' M' M ' 39' ' ' ARG . . . . . . . . . . . . . 3.5 tpt180 -57.56 -25.43 59.96 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.122 -0.49 . . . . 62.420000000000002 110.885 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' M' M ' 40' ' ' GLU . . . . . . . . . . . . . 12.4 mt-10 -85.94 -48.12 9.0 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.182 -0.463 . . . . 75.329999999999998 110.897 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' M' M ' 41' ' ' LEU . . . . . . . . . . . . . 9.8 mt -63.22 137.83 58.34 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.153 -0.476 . . . . 73.219999999999999 110.919 -179.941 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' M' M ' 42' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -64.32 160.11 19.57 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.188 -0.46 . . . . 73.049999999999997 110.898 179.916 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' M' M ' 43' ' ' ARG . . . . . . . . . . . . . 45.8 ttp180 . . . . . 0 C--N 1.329 -0.299 0 CA-C-N 116.088 -0.505 . . . . 73.349999999999994 110.873 -179.919 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 241' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 262' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 301' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 322' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.107 0 CA-C-O 120.788 0.328 . . . . 75.510000000000005 111.117 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 2.9 p-10 -165.48 84.49 0.36 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.24 -0.436 . . . . 73.439999999999998 110.879 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 6.9 pt20 -81.95 -172.2 3.79 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.185 -0.461 . . . . 64.310000000000002 110.886 -179.909 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 35.7 mt -87.33 131.08 34.38 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.217 -0.447 . . . . 74.540000000000006 110.92 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 77.4 p -102.74 167.78 9.67 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.16 -0.473 . . . . 70.439999999999998 111.119 179.961 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -52.18 -38.51 57.97 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.176 -0.465 . . . . 72.430000000000007 110.877 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -64.89 -32.12 73.68 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.178 -0.464 . . . . 74.540000000000006 110.866 -179.893 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 16.5 tp60 -77.62 -48.79 15.99 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.121 -0.49 . . . . 74.340000000000003 110.873 -179.905 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 72.0 mt -65.45 -47.25 87.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.201 -0.454 . . . . 75.510000000000005 111.112 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -56.23 -26.48 51.47 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.162 -0.472 . . . . 62.119999999999997 111.097 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -71.43 -44.31 65.11 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.227 -0.442 . . . . 75.120000000000005 110.882 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 26.1 m-85 -75.78 -45.9 33.69 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.207 -0.451 . . . . 75.019999999999996 110.876 -179.941 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 25.6 ttmt -55.47 -26.09 40.46 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.176 -0.466 . . . . 74.140000000000001 110.871 179.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 16.4 mm-40 -71.91 -40.25 68.97 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.24 -0.436 . . . . 71.340000000000003 110.889 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -60.1 -39.21 85.36 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.14 -0.482 . . . . 72.140000000000001 111.123 179.907 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 54.7 t80 -53.04 -52.02 59.86 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.193 -0.458 . . . . 75.439999999999998 110.909 -179.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 6.1 t -54.59 -30.37 54.32 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.171 -0.468 . . . . 74.150000000000006 110.852 -179.797 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 15.5 tp -66.36 -45.04 81.49 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.089 -0.505 . . . . 74.219999999999999 110.929 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 57.3 m-85 -75.2 -26.21 58.81 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.235 -0.439 . . . . 72.200000000000003 110.896 179.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 12.9 t0 -78.27 98.56 5.95 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.108 -0.496 . . . . 61.340000000000003 110.884 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 1.3 tppp? -68.23 -51.97 39.33 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.178 -0.465 . . . . 70.140000000000001 110.894 -179.989 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 23.5 p-10 -79.51 -10.07 59.73 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.225 -0.443 . . . . 63.43 110.815 179.933 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 52.11 42.35 54.83 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.771 -0.728 . . . . 60.009999999999998 112.468 -179.938 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 19.6 p-10 -88.73 -15.69 34.12 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.896 0.379 . . . . 54.409999999999997 110.871 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 104.64 16.72 16.74 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.758 -0.734 . . . . 52.43 112.524 -179.955 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -154.64 130.71 10.25 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.76 0.314 . . . . 75.530000000000001 111.13 -179.834 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 29.3 mt -89.18 123.77 41.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.252 -0.431 . . . . 74.120000000000005 111.108 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 43.5 p -98.58 -177.36 3.65 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.148 -0.478 . . . . 75.239999999999995 111.151 179.954 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 49.4 p -71.5 -39.56 70.75 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.235 -0.439 . . . . 74.140000000000001 111.171 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 45.2 mmtt -68.9 -50.09 52.57 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.192 -0.458 . . . . 75.450000000000003 110.881 179.906 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -59.19 -38.91 80.99 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.219 -0.446 . . . . 73.239999999999995 110.896 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.2 tt -74.3 -56.2 5.15 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.16 -0.473 . . . . 75.010000000000005 110.921 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -52.26 -44.42 57.83 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.748 -0.739 . . . . 74.140000000000001 112.46 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 92.4 m -56.49 -47.25 79.65 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.831 0.348 . . . . 65.400000000000006 111.165 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 97.0 t -62.78 -51.11 76.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.197 -0.456 . . . . 73.040000000000006 111.13 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 21.4 mtp -51.91 -33.87 38.93 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.185 -0.461 . . . . 70.340000000000003 110.891 179.87 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 59.0 ttt85 -57.07 -54.59 45.01 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.271 -0.422 . . . . 74.230000000000004 110.906 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.7 t -60.98 -26.22 67.41 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.196 -0.456 . . . . 53.520000000000003 110.879 -179.836 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 69.7 mt -79.73 -18.91 50.04 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.137 -0.483 . . . . 74.230000000000004 110.904 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 101.55 28.85 6.51 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.753 -0.737 . . . . 71.400000000000006 112.519 179.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 2.9 tt0 -128.69 106.5 8.98 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.776 0.322 . . . . 72.409999999999997 110.901 -179.84 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 6.0 t-20 -109.86 76.9 1.0 Allowed Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.625 0.726 . . . . 71.239999999999995 110.868 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.72 158.99 55.11 Favored 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.711 2.274 . . . . 71.209999999999994 112.361 179.903 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 66.4 p -76.61 160.19 29.63 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.217 -0.447 . . . . 74.319999999999993 111.159 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 7.9 mt-10 -51.97 -39.52 59.45 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.172 -0.467 . . . . 73.319999999999993 110.933 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.26 -31.57 64.17 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.126 -0.488 . . . . 72.540000000000006 111.111 179.895 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 59.8 tt0 -69.71 -47.94 61.33 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.187 -0.461 . . . . 72.549999999999997 110.919 -179.941 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 29.3 mt -55.34 -51.84 65.47 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.126 -0.488 . . . . 74.340000000000003 110.892 -179.961 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 41.4 tp60 -60.05 -28.99 68.23 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.255 -0.43 . . . . 62.219999999999999 110.955 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 39.3 t0 -67.13 -46.61 73.59 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.161 -0.472 . . . . 63.420000000000002 110.853 179.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 10.9 mtp -58.72 -58.03 10.37 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.215 -0.448 . . . . 74.540000000000006 110.872 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 74.1 mt -56.53 -37.56 52.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.224 -0.444 . . . . 74.420000000000002 111.148 179.976 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 63.9 m-20 -69.74 -34.63 74.11 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.17 -0.468 . . . . 75.010000000000005 110.883 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 25.5 mt-10 -61.57 -30.92 70.97 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.168 -0.469 . . . . 71.25 110.912 179.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 6.5 m -109.17 17.99 6.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.144 -0.48 . . . . 70.510000000000005 111.121 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 32.3 t0 -90.11 97.25 11.08 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.176 -0.466 . . . . 72.450000000000003 110.865 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.13 -45.32 10.23 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.151 -0.477 . . . . 72.409999999999997 111.09 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 19.8 p-10 -81.85 -0.09 41.94 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.256 -0.429 . . . . 74.209999999999994 110.86 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 54.35 57.31 17.65 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.736 -0.745 . . . . 74.140000000000001 112.484 -179.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 48.3 p-10 -114.48 -15.71 12.01 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.877 0.37 . . . . 61.450000000000003 110.902 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 90.28 21.94 36.57 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.773 -0.727 . . . . 64.219999999999999 112.489 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 76.0 p -150.94 165.07 34.82 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.731 0.301 . . . . 73.329999999999998 111.119 -179.86 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 28.0 mt -94.61 114.44 31.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.187 -0.461 . . . . 73.430000000000007 111.099 179.891 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -78.41 -172.91 3.07 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.168 -0.469 . . . . 72.310000000000002 110.871 179.838 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.52 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 2.5 t80 -63.97 -58.4 14.75 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-O 121.672 0.748 . . . . 74.340000000000003 110.895 -179.902 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . 0.52 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 53.8 Cg_endo -69.7 -32.08 19.54 Favored 'Trans proline' 0 C--N 1.341 0.136 0 C-N-CA 122.724 2.283 . . . . 74.400000000000006 112.387 179.985 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 74.1 mt-10 -57.25 -42.67 81.94 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.166 -0.47 . . . . 73.230000000000004 110.907 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 78.7 t80 -70.83 -36.45 72.92 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.13 -0.486 . . . . 71.400000000000006 110.9 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 15.4 tp -67.53 -53.7 26.26 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.136 -0.484 . . . . 74.530000000000001 110.973 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 14.9 t -57.24 -29.43 63.78 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.16 -0.473 . . . . 74.150000000000006 111.185 179.899 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 45.8 ttp -61.15 -42.32 98.35 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.176 -0.466 . . . . 73.540000000000006 110.898 179.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 8.8 mtt -79.78 -45.91 17.95 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.217 -0.447 . . . . 73.519999999999996 110.918 179.939 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -53.1 -30.98 39.52 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.215 -0.448 . . . . 74.109999999999999 111.086 179.886 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.42 -27.63 64.48 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.261 -0.427 . . . . 74.25 110.873 -179.941 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.83 -32.33 70.56 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.191 -0.459 . . . . 75.109999999999999 110.878 -179.992 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 70.8 mtp -53.85 -61.68 2.15 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.232 -0.44 . . . . 64.450000000000003 110.898 179.844 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -123.61 137.54 54.72 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.239 -0.437 . . . . 75.409999999999997 110.909 179.955 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 8.3 p-10 -125.85 -171.41 2.38 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.275 -0.42 . . . . 74.120000000000005 110.832 179.907 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 1.9 m -64.96 -30.54 71.53 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.174 -0.466 . . . . 73.310000000000002 111.118 -179.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 33.2 m-20 -55.53 -26.17 41.56 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.262 -0.426 . . . . 55.240000000000002 110.881 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 12.5 t -52.08 -40.68 61.57 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.146 -0.479 . . . . 72.109999999999999 110.893 -179.777 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -60.89 -33.55 73.28 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.129 -0.487 . . . . 75.310000000000002 110.863 -179.954 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 12.0 tt0 -64.38 -44.49 91.18 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.18 -0.463 . . . . 73.230000000000004 110.87 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -57.7 -27.1 62.63 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.147 -0.479 . . . . 72.420000000000002 110.898 -179.935 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 57.8 mt -73.89 -48.9 37.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.124 -0.489 . . . . 73.329999999999998 111.091 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 46.3 ttp180 -71.65 -28.22 63.61 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.181 -0.463 . . . . 74.239999999999995 110.897 179.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 -71.89 -29.14 64.03 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.164 -0.471 . . . . 74.5 110.888 -179.914 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -76.35 -35.64 58.62 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.14 -0.482 . . . . 63.409999999999997 111.096 179.949 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 3.9 t80 -56.82 -49.31 75.79 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.196 -0.456 . . . . 74.030000000000001 110.863 -179.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 10.5 ptm180 -62.82 -26.16 68.6 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.102 -0.499 . . . . 72.519999999999996 110.888 -179.886 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 91.8 t -74.0 -45.74 47.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.201 -0.454 . . . . 75.209999999999994 111.156 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 9.5 m-85 -75.54 -34.76 60.78 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.126 -0.488 . . . . 74.140000000000001 110.864 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 28.5 t0 -64.52 93.05 0.09 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.175 -0.466 . . . . 63.409999999999997 110.867 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 1.5 ttmp? -78.71 -52.75 7.96 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.175 -0.466 . . . . 75.239999999999995 110.883 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 54.1 p-10 -72.71 -9.08 58.21 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.201 -0.454 . . . . 74.420000000000002 110.854 179.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 60.97 33.53 84.21 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.759 -0.734 . . . . 64.540000000000006 112.517 -179.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 40.7 p-10 -85.52 -16.22 40.22 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.876 0.37 . . . . 72.099999999999994 110.896 -179.9 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 85.87 18.63 59.37 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.732 -0.747 . . . . 62.119999999999997 112.497 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 14.5 m-85 -140.75 151.01 44.11 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.833 0.349 . . . . 53.039999999999999 110.947 -179.799 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 64.0 mt -115.82 127.24 73.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.144 -0.48 . . . . 72.109999999999999 111.172 179.877 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 89.4 p -116.62 -171.47 2.02 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.186 -0.461 . . . . 74.340000000000003 110.836 -179.87 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -68.61 -44.77 73.58 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.133 -0.485 . . . . 74.430000000000007 111.085 179.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -63.8 -38.01 89.51 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.223 -0.444 . . . . 63.210000000000001 111.063 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 23.6 mt-10 -76.04 -52.07 10.96 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.216 -0.447 . . . . 74.200000000000003 110.858 -179.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 35.2 tp -53.37 -52.42 59.31 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.192 -0.458 . . . . 75.140000000000001 110.952 179.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 50.8 ttt180 -52.27 -43.48 64.41 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.187 -0.46 . . . . 75.120000000000005 110.883 179.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 77.6 t60 -54.27 -34.43 60.81 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.147 -0.478 . . . . 74.239999999999995 110.893 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 92.8 t -70.25 -48.28 62.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.18 -0.463 . . . . 74.349999999999994 111.133 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -64.4 -28.23 69.54 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.186 -0.461 . . . . 73.200000000000003 110.877 179.885 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 15.6 m -62.53 -30.95 71.66 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.238 -0.437 . . . . 74.319999999999993 111.145 -179.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -74.71 -25.34 59.06 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.258 -0.428 . . . . 74.340000000000003 110.899 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -70.63 -25.68 63.14 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.137 -0.483 . . . . 72.430000000000007 110.948 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 99.62 19.77 19.22 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.747 -0.739 . . . . 61.200000000000003 112.466 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -103.44 112.86 25.96 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.961 0.41 . . . . 74.219999999999999 110.862 -179.845 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 16.2 mtpp -65.07 124.59 22.51 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.167 -0.47 . . . . 74.140000000000001 110.86 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 5.2 mt -138.65 160.51 39.46 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.234 -0.439 . . . . 75.420000000000002 110.883 179.909 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 34.5 p -118.87 167.61 11.55 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.161 -0.472 . . . . 63.439999999999998 111.113 179.976 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 51.8 m-20 -52.34 -35.83 51.9 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.24 -0.437 . . . . 75.200000000000003 110.882 179.915 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 84.4 tt0 -72.81 -35.34 67.31 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.18 -0.464 . . . . 64.400000000000006 110.916 -179.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 36.2 tp10 -64.8 -44.54 89.59 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.138 -0.483 . . . . 63.130000000000003 110.872 -179.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 58.3 t -57.44 -40.46 74.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.159 -0.473 . . . . 70.010000000000005 111.092 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -52.2 -49.82 63.13 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.235 -0.439 . . . . 64.219999999999999 110.83 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 15.7 tp10 -55.8 -29.43 59.71 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.21 -0.45 . . . . 74.530000000000001 110.93 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 2.9 ttt -72.65 -59.87 2.51 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.149 -0.478 . . . . 65.349999999999994 110.876 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 33.7 mm -54.25 -35.72 30.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.229 -0.441 . . . . 75.439999999999998 111.129 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 40.8 ttt180 -63.41 -31.79 73.04 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.172 -0.467 . . . . 75.239999999999995 110.869 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 12.2 tm-20 -72.85 -50.65 22.67 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.169 -0.469 . . . . 74.530000000000001 110.932 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -69.68 -26.83 64.56 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.145 -0.48 . . . . 72.409999999999997 111.091 179.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 51.2 t0 -75.04 86.49 2.34 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.241 -0.436 . . . . 73.049999999999997 110.853 179.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 4.9 mt -79.89 -45.19 22.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.215 -0.448 . . . . 75.129999999999995 111.139 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 18.2 p30 -72.42 -8.9 57.46 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.206 -0.452 . . . . 75.319999999999993 110.853 179.843 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 62.64 43.95 98.24 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.705 -0.759 . . . . 64.540000000000006 112.455 -179.927 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 33.7 p-10 -89.56 -15.96 31.71 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.858 0.361 . . . . 73.150000000000006 110.839 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 101.63 3.86 52.62 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.719 -0.753 . . . . 55.32 112.526 -179.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 4.7 tt0 -149.2 172.23 15.17 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.796 0.332 . . . . 73.120000000000005 110.918 -179.863 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 136' ' ' VAL . . . . . . . . . . . . . 95.9 t -114.08 111.49 36.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.197 -0.456 . . . . 73.530000000000001 111.131 179.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 14.7 p30 -91.46 170.96 9.53 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.215 -0.448 . . . . 74.150000000000006 110.909 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 45.5 t80 -55.01 -47.37 74.76 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.141 -0.481 . . . . 74.040000000000006 110.953 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -52.25 -50.62 61.7 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.112 -0.494 . . . . 72.040000000000006 110.879 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 95.6 mt-10 -66.77 -31.72 72.55 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.152 -0.476 . . . . 75.430000000000007 110.885 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 49.8 t80 -67.61 -50.18 59.4 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.147 -0.479 . . . . 74.200000000000003 110.861 -179.946 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 73.0 t -62.79 -38.5 81.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.172 -0.467 . . . . 75.219999999999999 111.102 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 64.6 tt0 -57.46 -36.71 71.8 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.183 -0.462 . . . . 75.530000000000001 110.941 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 11.5 tpt -74.3 -55.47 5.98 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.182 -0.463 . . . . 75.25 110.896 179.938 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 21.0 ttm -59.42 -22.44 61.45 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.225 -0.443 . . . . 74.120000000000005 110.865 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 94.8 m -91.05 -41.73 10.91 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.249 -0.432 . . . . 71.150000000000006 111.167 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -95.8 -75.64 0.52 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.206 -0.452 . . . . 55.329999999999998 111.153 179.842 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 116.179 -0.464 . . . . 72.519999999999996 110.889 179.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' M' M ' 8' ' ' LEU . . . . . . . . . . . . . 2.1 pt? . . . . . 0 C--O 1.231 0.108 0 CA-C-O 120.835 0.35 . . . . 73.530000000000001 110.944 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' M' M ' 9' ' ' SER . . . . . . . . . . . . . 3.1 m -90.62 78.19 6.29 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.206 -0.452 . . . . 75.239999999999995 110.895 -179.955 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' M' M ' 10' ' ' GLY . . . . . . . . . . . . . . . -167.62 154.3 24.34 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.755 -0.736 . . . . 75.519999999999996 112.516 -179.97 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' M' M ' 11' ' ' GLY . . . . . . . . . . . . . . . 106.8 -29.21 11.15 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.716 -0.754 . . . . 72.409999999999997 112.513 -179.9 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' M' M ' 12' ' ' GLU . . . . . . . . . . . . . 17.4 pt-20 -66.02 -174.26 0.23 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.895 0.379 . . . . 73.510000000000005 110.904 -179.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' M' M ' 13' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -87.35 75.95 9.18 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.179 -0.464 . . . . 73.010000000000005 110.924 -179.968 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' M' M ' 14' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -102.8 25.65 9.0 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.169 -0.469 . . . . 71.540000000000006 110.827 179.887 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' M' M ' 15' ' ' LYS . . . . . . . . . . . . . 4.3 mtmp? -77.48 -34.25 54.34 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.222 -0.444 . . . . 75.439999999999998 110.895 179.976 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' M' M ' 16' ' ' TRP . . . . . . . . . . . . . 44.3 m95 -51.83 -30.12 22.14 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.233 -0.439 . . . . 75.239999999999995 110.92 179.891 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' M' M ' 17' ' ' GLU . . . . . . . . . . . . . 5.4 tm-20 -54.25 -39.32 66.72 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.983 0.42 . . . . 75.430000000000007 110.911 -179.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' M' M ' 18' ' ' LYS . . . . . . . . . . . . . 4.8 ttpm? -62.82 -23.44 67.27 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.12 -0.491 . . . . 74.219999999999999 110.887 179.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' M' M ' 19' ' ' ILE . . . . . . . . . . . . . 21.8 mm -70.89 -34.35 55.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.209 -0.45 . . . . 71.519999999999996 111.105 179.924 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' M' M ' 20' ' ' ARG . . . . . . . . . . . . . 25.4 ttm180 -60.8 -26.63 67.43 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.192 -0.458 . . . . 71.400000000000006 110.868 179.961 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' M' M ' 21' ' ' LEU . . . . . . . . . . . . . 6.7 mt 59.4 178.06 0.08 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.186 -0.461 . . . . 73.209999999999994 110.881 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' M' M ' 22' ' ' ARG . . . . . . . . . . . . . 19.9 mtm180 -74.74 143.8 79.09 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.587 0.708 . . . . 74.510000000000005 110.83 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' M' M ' 23' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.75 -170.93 0.42 Allowed 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.649 2.233 . . . . 64.099999999999994 112.347 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' M' M ' 24' ' ' GLY . . . . . . . . . . . . . . . 144.08 117.61 1.19 Allowed Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.771 -0.728 . . . . 74.209999999999994 112.476 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' M' M ' 25' ' ' GLY . . . . . . . . . . . . . . . 157.07 155.96 7.69 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.78 -0.724 . . . . 64.439999999999998 112.529 -179.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' M' M ' 26' ' ' LYS . . . . . . . . . . . . . 16.2 pttm -177.71 115.16 0.08 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.812 0.339 . . . . 72.310000000000002 110.933 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' M' M ' 27' ' ' LYS . . . . . . . . . . . . . 24.5 tptt -150.13 59.77 0.97 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.215 -0.448 . . . . 73.209999999999994 110.91 179.881 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' M' M ' 28' ' ' GLN . . . . . . . . . . . . . 1.7 tm0? -173.37 162.6 4.36 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.231 -0.44 . . . . 74.430000000000007 110.882 180.0 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' M' M ' 29' ' ' TYR . . . . . . . . . . . . . 6.3 m-85 60.03 171.8 0.08 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.163 -0.471 . . . . 73.219999999999999 110.863 -179.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' M' M ' 30' ' ' LYS . . . . . . . . . . . . . 8.1 pttm -178.35 33.91 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.096 -0.502 . . . . 75.340000000000003 110.888 179.912 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' M' M ' 31' ' ' LEU . . . . . . . . . . . . . 19.4 tp -121.92 -34.66 3.32 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.242 -0.435 . . . . 75.120000000000005 110.891 179.938 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' M' M ' 32' ' ' LYS . . . . . . . . . . . . . 4.8 pttm -51.31 -39.85 57.79 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.223 -0.444 . . . . 74.0 110.865 179.838 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' M' M ' 33' ' ' HIS . . . . . . . . . . . . . 10.4 t-160 -50.92 -36.74 40.02 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.245 -0.434 . . . . 74.239999999999995 110.848 179.91 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' M' M ' 34' ' ' ILE . . . . . . . . . . . . . 50.7 mm -50.16 -39.17 15.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.203 -0.453 . . . . 75.099999999999994 111.136 -179.961 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' M' M ' 35' ' ' VAL . . . . . . . . . . . . . 58.3 t -49.31 -39.76 13.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.161 -0.472 . . . . 74.409999999999997 111.144 179.836 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' M' M ' 36' ' ' TRP . . . . . . . . . . . . . 23.0 m0 -58.64 -39.36 80.32 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.141 -0.481 . . . . 73.420000000000002 110.931 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' M' M ' 37' ' ' ALA . . . . . . . . . . . . . . . -63.84 -18.65 64.36 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.23 -0.441 . . . . 74.239999999999995 111.05 179.935 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' M' M ' 38' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -72.9 -18.06 61.45 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.229 -0.441 . . . . 75.439999999999998 110.853 -179.811 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' M' M ' 39' ' ' ARG . . . . . . . . . . . . . 20.0 ptt180 -57.69 -26.3 61.51 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.17 -0.468 . . . . 74.109999999999999 110.873 -179.899 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' M' M ' 40' ' ' GLU . . . . . . . . . . . . . 12.7 tp10 -85.86 -47.94 9.22 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.161 -0.472 . . . . 74.340000000000003 110.856 -179.914 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' M' M ' 41' ' ' LEU . . . . . . . . . . . . . 13.3 mt -62.78 147.97 48.28 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.163 -0.471 . . . . 73.030000000000001 110.866 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' M' M ' 42' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -121.23 35.17 4.97 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.178 -0.465 . . . . 73.400000000000006 110.856 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' M' M ' 43' ' ' ARG . . . . . . . . . . . . . 53.3 ttp85 . . . . . 0 C--N 1.329 -0.3 0 CA-C-N 116.169 -0.469 . . . . 74.299999999999997 110.877 -179.926 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 241' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 262' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 301' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 322' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.457 -0.117 0 CA-C-O 120.824 0.345 . . . . 74.099999999999994 111.088 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -69.83 154.97 41.25 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.205 -0.452 . . . . 65.439999999999998 110.896 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 20.4 mt-30 56.46 -177.25 0.05 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.204 -0.453 . . . . 73.409999999999997 110.907 -179.906 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 8.0 mt -122.67 157.35 32.42 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.168 -0.469 . . . . 75.219999999999999 110.933 -179.964 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 70.2 p -121.37 177.85 5.02 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.214 -0.448 . . . . 73.230000000000004 111.104 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -54.04 -29.79 45.18 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.219 -0.446 . . . . 64.319999999999993 110.895 -179.986 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -65.13 -40.86 95.05 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.148 -0.478 . . . . 71.310000000000002 110.887 -179.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 18.5 tt0 -78.02 -43.15 30.27 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.162 -0.472 . . . . 62.539999999999999 110.883 -179.916 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 60.5 mt -65.56 -37.12 79.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.242 -0.435 . . . . 73.530000000000001 111.167 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -54.6 -51.83 64.1 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.176 -0.465 . . . . 72.319999999999993 111.126 179.784 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -62.34 -49.2 76.52 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.174 -0.466 . . . . 72.5 110.918 -179.959 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 14.2 m-85 -55.85 -45.82 78.34 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.155 -0.475 . . . . 63.530000000000001 110.849 -179.941 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 26.6 ttpt -55.46 -25.95 39.47 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.163 -0.472 . . . . 70.310000000000002 110.927 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 16.2 tt0 -75.11 -31.07 61.05 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.178 -0.465 . . . . 75.430000000000007 110.856 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -70.67 -33.41 70.91 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.14 -0.482 . . . . 63.240000000000002 111.096 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 93.9 t80 -75.56 -54.21 7.37 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.232 -0.44 . . . . 65.310000000000002 110.886 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 17.4 t -53.23 -29.56 33.21 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.134 -0.485 . . . . 52.43 110.888 -179.827 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 16.1 tp -63.58 -41.82 98.33 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.114 -0.494 . . . . 74.519999999999996 110.873 -179.954 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 20.1 m-85 -77.55 -30.9 52.95 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.194 -0.457 . . . . 72.040000000000006 110.9 179.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 13.3 t0 -76.96 98.62 4.99 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.124 -0.489 . . . . 73.420000000000002 110.877 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 6.2 tptt -66.47 -49.93 64.99 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.186 -0.461 . . . . 72.25 110.938 179.948 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 24.7 p-10 -81.87 -10.2 59.38 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.237 -0.438 . . . . 75.030000000000001 110.852 179.878 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 51.59 44.84 54.33 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.773 -0.727 . . . . 73.310000000000002 112.427 -179.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 29.4 p-10 -88.32 -15.52 35.48 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.852 0.358 . . . . 74.230000000000004 110.897 179.989 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 105.45 -11.63 47.1 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.746 -0.74 . . . . 72.439999999999998 112.474 -179.943 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 32.8 p -130.4 130.6 44.55 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.734 0.302 . . . . 72.430000000000007 111.159 -179.831 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 24.2 mt -96.34 112.64 28.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.236 -0.438 . . . . 71.230000000000004 111.143 179.924 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 21.0 p -95.57 175.52 6.52 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.199 -0.455 . . . . 63.439999999999998 111.162 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 60.4 p -60.35 -37.2 79.92 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.23 -0.441 . . . . 63.539999999999999 111.154 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 19.9 mmmt -60.23 -50.11 74.95 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.209 -0.451 . . . . 74.439999999999998 110.932 179.857 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -72.11 -32.73 67.25 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.213 -0.448 . . . . 70.340000000000003 110.876 179.986 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -67.83 -44.48 77.12 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.145 -0.479 . . . . 72.219999999999999 110.951 179.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -71.7 -27.94 70.03 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.721 -0.752 . . . . 75.150000000000006 112.532 179.87 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 96.5 m -70.31 -53.64 15.95 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.867 0.365 . . . . 73.310000000000002 111.128 -179.869 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 46.8 t -52.53 -51.7 32.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.189 -0.459 . . . . 75.319999999999993 111.105 179.937 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -51.89 -39.41 58.99 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.174 -0.466 . . . . 74.219999999999999 110.895 179.919 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 21.7 ttt-85 -57.01 -44.67 83.05 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.241 -0.436 . . . . 73.439999999999998 110.824 -179.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.1 p -67.49 -26.34 66.31 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.217 -0.447 . . . . 75.219999999999999 110.835 -179.74 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 48.7 mt -85.64 -21.39 28.44 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.084 -0.507 . . . . 70.219999999999999 110.927 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 101.44 31.14 5.64 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.736 -0.745 . . . . 73.319999999999993 112.498 179.941 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 10.6 mt-30 -119.56 122.69 42.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.777 0.322 . . . . 63.329999999999998 110.94 -179.896 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 22.7 t-20 -109.86 76.84 0.99 Allowed Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 121.627 0.727 . . . . 75.150000000000006 110.918 -179.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.76 140.23 42.19 Favored 'Trans proline' 0 C--N 1.342 0.196 0 C-N-CA 122.68 2.253 . . . . 73.540000000000006 112.359 179.938 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 29.6 p -72.64 161.63 30.53 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.209 -0.45 . . . . 75.310000000000002 111.154 -179.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 67.9 tt0 -52.04 -42.9 63.47 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.22 -0.446 . . . . 73.420000000000002 110.919 179.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.0 -31.54 64.56 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.184 -0.462 . . . . 72.329999999999998 111.131 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 55.5 tt0 -66.22 -50.48 63.69 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.157 -0.474 . . . . 74.420000000000002 110.872 -179.915 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 40.5 mt -55.17 -47.12 75.62 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.153 -0.476 . . . . 75.140000000000001 110.908 -179.954 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 21.1 tp60 -66.42 -29.03 69.09 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.203 -0.453 . . . . 73.510000000000005 110.847 179.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 37.9 t0 -70.68 -49.57 45.88 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.26 -0.427 . . . . 74.209999999999994 110.877 179.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 31.8 mtp -59.54 -57.98 10.6 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.174 -0.466 . . . . 75.400000000000006 110.874 179.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 61.7 mt -53.29 -43.82 51.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.181 -0.463 . . . . 75.140000000000001 111.108 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 71.7 m-20 -64.0 -38.84 92.54 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.145 -0.48 . . . . 75.549999999999997 110.906 179.952 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -60.62 -32.08 71.24 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.185 -0.462 . . . . 72.519999999999996 110.889 179.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 26.5 m -105.31 14.7 7.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.141 -0.481 . . . . 75.310000000000002 111.118 -180.0 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 31.0 t0 -90.07 100.19 13.06 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.201 -0.454 . . . . 64.519999999999996 110.874 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.23 -45.85 9.73 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.206 -0.452 . . . . 64.230000000000004 111.084 179.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 16.8 p-10 -81.67 -0.19 41.55 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.246 -0.433 . . . . 73.420000000000002 110.87 179.952 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 53.42 56.15 21.15 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.743 -0.742 . . . . 63.420000000000002 112.473 -179.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 52.0 p-10 -114.49 -15.71 12.01 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.858 0.361 . . . . 73.299999999999997 110.907 -179.903 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 91.73 15.59 54.26 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.743 -0.741 . . . . 71.239999999999995 112.525 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 40.0 p -148.01 163.75 35.9 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.776 0.322 . . . . 74.25 111.139 -179.843 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 24.2 mt -99.9 109.5 24.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.2 -0.454 . . . . 75.230000000000004 111.141 179.868 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 4.6 t0 -75.42 -172.97 1.94 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.155 -0.475 . . . . 71.049999999999997 110.831 179.863 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.516 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 2.5 t80 -65.68 -58.42 11.62 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 121.618 0.723 . . . . 74.239999999999995 110.891 -179.886 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . 0.516 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 54.1 Cg_endo -69.74 -25.5 28.65 Favored 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.667 2.245 . . . . 72.230000000000004 112.376 179.961 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 17.4 mt-10 -61.61 -43.57 98.62 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.222 -0.444 . . . . 63.329999999999998 110.871 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 21.7 t80 -71.21 -36.21 71.8 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.172 -0.467 . . . . 72.219999999999999 110.921 -179.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 21.4 tp -62.56 -53.79 49.46 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.133 -0.485 . . . . 74.239999999999995 110.901 179.989 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 9.9 t -60.48 -30.96 70.02 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.146 -0.479 . . . . 62.009999999999998 111.116 179.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 7.9 tmm? -61.45 -46.76 88.74 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.233 -0.439 . . . . 74.409999999999997 110.902 179.914 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -76.07 -48.57 20.32 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.216 -0.447 . . . . 75.099999999999994 110.886 179.948 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -56.26 -28.53 58.94 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.267 -0.424 . . . . 63.109999999999999 111.107 179.923 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 16.7 ttt85 -64.87 -19.27 65.8 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.189 -0.46 . . . . 72.310000000000002 110.872 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 48.2 pttt -52.52 -29.4 25.0 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.254 -0.43 . . . . 71.310000000000002 110.9 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 5.4 ptt? -115.92 19.23 15.22 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.197 -0.456 . . . . 74.329999999999998 110.884 179.864 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 1.9 tmtm? -99.21 -68.77 0.79 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.258 -0.428 . . . . 72.219999999999999 110.861 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -173.02 -176.75 1.45 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.254 -0.43 . . . . 71.549999999999997 110.892 179.928 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 1.9 m 63.67 106.61 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.212 -0.449 . . . . 74.409999999999997 111.168 -179.868 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -168.61 -38.79 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.218 -0.446 . . . . 70.099999999999994 110.892 179.902 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 14.9 t -53.14 -34.75 58.14 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.151 -0.477 . . . . 74.239999999999995 110.873 -179.78 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 20.2 tp10 -56.49 -26.64 54.95 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.097 -0.501 . . . . 75.349999999999994 110.864 -179.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 5.4 tm-20 -75.84 -47.24 26.37 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.169 -0.468 . . . . 72.200000000000003 110.913 -179.919 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 5.1 mp0 -54.58 -40.2 68.57 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.144 -0.48 . . . . 75.230000000000004 110.867 -179.903 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 67.3 mt -57.47 -36.1 52.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.142 -0.481 . . . . 75.530000000000001 111.115 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.06 -32.03 71.22 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.195 -0.457 . . . . 74.430000000000007 110.843 179.991 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 8.3 tm-20 -75.67 -51.67 12.24 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.177 -0.465 . . . . 75.219999999999999 110.85 -179.881 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -54.73 -50.96 67.11 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.163 -0.472 . . . . 61.219999999999999 111.069 179.957 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 22.2 t80 -53.47 -44.49 69.01 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.207 -0.451 . . . . 75.530000000000001 110.839 -179.862 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 1.6 tmm_? -66.64 -46.04 77.05 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.176 -0.465 . . . . 72.239999999999995 110.889 -179.938 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 91.6 t -54.42 -51.02 53.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.18 -0.463 . . . . 75.519999999999996 111.11 -179.994 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 19.6 m-85 -66.13 -27.1 67.78 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.194 -0.457 . . . . 73.140000000000001 110.866 -179.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 31.4 t0 -69.67 95.21 0.85 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.13 -0.487 . . . . 60.439999999999998 110.855 179.989 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 5.7 mptp? -78.42 -52.59 8.33 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.198 -0.455 . . . . 74.109999999999999 110.865 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 44.2 p30 -72.63 -9.04 58.12 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.235 -0.438 . . . . 64.150000000000006 110.902 179.867 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 59.68 27.05 63.35 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.715 -0.755 . . . . 75.340000000000003 112.509 -179.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 40.0 p-10 -82.06 -16.19 50.98 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.847 0.356 . . . . 74.540000000000006 110.882 -179.928 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 84.79 18.67 61.1 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.683 -0.77 . . . . 55.229999999999997 112.517 179.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 20.6 m-85 -140.66 135.26 31.49 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.856 0.36 . . . . 73.420000000000002 110.936 -179.787 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 66.2 mt -102.27 126.83 56.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.125 -0.489 . . . . 75.5 111.164 179.908 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 28.7 p -111.66 -174.59 2.5 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.198 -0.456 . . . . 72.340000000000003 110.844 -179.891 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -71.2 -34.5 70.91 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.113 -0.494 . . . . 71.140000000000001 111.116 179.915 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -71.98 -44.83 62.88 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.209 -0.45 . . . . 75.420000000000002 111.089 179.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -69.09 -50.13 51.01 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.229 -0.441 . . . . 73.030000000000001 110.914 -179.934 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 42.5 tp -52.94 -33.3 50.22 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.183 -0.462 . . . . 74.540000000000006 110.94 179.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 58.4 ttp85 -73.74 -36.95 65.22 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.202 -0.453 . . . . 75.140000000000001 110.896 179.943 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 2.0 t60 -54.34 -38.11 65.66 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.123 -0.49 . . . . 75.310000000000002 110.892 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 23.3 t -69.86 -48.14 65.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.162 -0.472 . . . . 74.349999999999994 111.137 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 2.4 mmt -59.72 -38.27 81.22 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.196 -0.456 . . . . 73.510000000000005 110.902 179.906 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 8.0 m -52.25 -43.03 64.13 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.218 -0.446 . . . . 65.329999999999998 111.176 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -68.34 -28.91 67.56 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.203 -0.453 . . . . 65.25 110.874 179.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 1.1 tt -70.87 -26.12 63.11 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.207 -0.452 . . . . 74.400000000000006 110.893 179.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 99.81 30.57 6.38 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.712 -0.756 . . . . 61.219999999999999 112.476 179.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -115.87 113.39 23.28 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.892 0.377 . . . . 75.519999999999996 110.884 -179.856 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 14.9 pttp -64.19 116.24 5.79 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.187 -0.46 . . . . 73.549999999999997 110.91 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 14.2 mt -145.25 133.36 21.5 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.231 -0.441 . . . . 75.310000000000002 110.893 179.964 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 27.8 p -107.42 -177.13 3.26 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.167 -0.469 . . . . 73.209999999999994 111.153 179.994 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -58.91 -37.78 77.43 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.264 -0.425 . . . . 75.030000000000001 110.826 179.907 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 61.5 tt0 -73.91 -33.92 64.18 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.181 -0.463 . . . . 73.129999999999995 110.86 -179.895 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 10.4 tt0 -74.06 -37.21 64.32 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.172 -0.467 . . . . 73.0 110.874 -179.901 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 61.0 t -74.29 -31.0 27.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.137 -0.483 . . . . 74.349999999999994 111.106 179.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -52.01 -45.32 64.5 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.172 -0.467 . . . . 71.219999999999999 110.864 179.903 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 21.5 tp10 -56.07 -29.69 60.9 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.186 -0.461 . . . . 52.130000000000003 110.887 -179.893 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 14.6 mtp -75.06 -57.39 3.93 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.161 -0.472 . . . . 74.430000000000007 110.823 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 35.8 mm -53.88 -35.65 28.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.233 -0.439 . . . . 71.409999999999997 111.151 -179.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 22.1 ttp85 -63.38 -31.8 73.05 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.125 -0.489 . . . . 74.519999999999996 110.861 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 20.0 tp10 -75.01 -52.41 11.15 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.21 -0.45 . . . . 72.040000000000006 110.861 -179.922 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -64.96 -34.41 78.37 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.175 -0.466 . . . . 65.230000000000004 111.106 179.952 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 49.2 t0 -68.42 86.67 0.29 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.208 -0.451 . . . . 74.310000000000002 110.888 179.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 58.0 mt -79.8 -46.34 22.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.218 -0.446 . . . . 63.240000000000002 111.139 179.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 21.2 p30 -72.66 -8.74 56.83 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.225 -0.443 . . . . 73.230000000000004 110.87 179.837 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 62.79 42.97 99.59 Favored Glycine 0 N--CA 1.452 -0.245 0 C-N-CA 120.738 -0.744 . . . . 50.420000000000002 112.456 -179.912 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 34.6 p-10 -88.07 -15.89 35.05 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.809 0.338 . . . . 71.439999999999998 110.879 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 104.11 2.25 45.11 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.709 -0.758 . . . . 74.299999999999997 112.514 -179.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 4.0 tt0 -149.14 172.24 15.13 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.852 0.358 . . . . 72.019999999999996 110.903 -179.876 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 136' ' ' VAL . . . . . . . . . . . . . 92.9 t -106.75 109.87 29.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.213 -0.449 . . . . 55.409999999999997 111.093 179.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 20.4 p30 -90.97 164.86 13.84 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.15 -0.477 . . . . 72.409999999999997 110.903 179.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 70.1 t80 -52.05 -46.72 65.19 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.135 -0.484 . . . . 73.25 110.922 -179.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 11.5 tm-20 -51.92 -39.98 60.02 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.148 -0.478 . . . . 70.209999999999994 110.873 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 22.5 mt-10 -78.41 -41.69 32.36 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.153 -0.476 . . . . 75.409999999999997 110.929 -179.923 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 64.6 t80 -59.29 -35.8 74.41 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.128 -0.487 . . . . 75.530000000000001 110.899 -179.957 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 91.4 t -71.28 -37.87 67.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.153 -0.476 . . . . 74.340000000000003 111.137 179.953 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 39.9 tp60 -73.94 -31.23 62.95 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.199 -0.455 . . . . 73.439999999999998 110.922 179.986 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 9.0 tpt -74.11 -56.54 4.79 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.2 -0.454 . . . . 75.040000000000006 110.877 179.948 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 12.3 ttm -61.48 -26.09 67.67 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.286 -0.415 . . . . 71.120000000000005 110.879 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 2.5 m -109.78 21.31 17.06 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.229 -0.442 . . . . 75.319999999999993 111.107 -179.87 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -51.76 115.59 1.72 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.171 -0.468 . . . . 73.430000000000007 111.103 179.823 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.289 0 CA-C-N 116.234 -0.439 . . . . 75.549999999999997 110.928 179.939 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' M' M ' 8' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.231 0.117 0 CA-C-O 120.757 0.313 . . . . 75.099999999999994 110.913 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' M' M ' 9' ' ' SER . . . . . . . . . . . . . 1.8 t 62.02 48.02 5.43 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.194 -0.457 . . . . 73.010000000000005 110.844 -179.956 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' M' M ' 10' ' ' GLY . . . . . . . . . . . . . . . -90.2 166.38 32.13 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.797 -0.716 . . . . 64.25 112.499 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' M' M ' 11' ' ' GLY . . . . . . . . . . . . . . . -69.9 173.88 37.53 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.72 -0.752 . . . . 65.409999999999997 112.491 -179.879 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' M' M ' 12' ' ' GLU . . . . . . . . . . . . . 19.9 mt-10 -112.24 -58.2 2.17 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.884 0.373 . . . . 71.519999999999996 110.932 -179.913 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' M' M ' 13' ' ' LEU . . . . . . . . . . . . . 2.5 tt -87.97 129.21 35.32 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.13 -0.487 . . . . 73.420000000000002 110.901 -179.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' M' M ' 14' ' ' ASP . . . . . . . . . . . . . 41.4 t0 -78.64 59.27 2.44 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.222 -0.445 . . . . 63.399999999999999 110.856 179.855 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' M' M ' 15' ' ' LYS . . . . . . . . . . . . . 18.9 mttp -69.43 -42.31 75.16 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.207 -0.451 . . . . 64.049999999999997 110.871 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' M' M ' 16' ' ' TRP . . . . . . . . . . . . . 10.6 m95 -51.76 -46.91 64.26 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.247 -0.433 . . . . 75.510000000000005 110.944 179.904 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' M' M ' 17' ' ' GLU . . . . . . . . . . . . . 3.1 tm-20 -55.36 -27.1 45.09 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.189 -0.46 . . . . 75.340000000000003 110.889 -179.965 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' M' M ' 18' ' ' LYS . . . . . . . . . . . . . 8.7 ttmm -75.61 -28.93 59.05 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.127 -0.488 . . . . 74.209999999999994 110.891 179.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' M' M ' 19' ' ' ILE . . . . . . . . . . . . . 54.5 mt -78.95 -24.86 13.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.207 -0.451 . . . . 75.439999999999998 111.166 179.832 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' M' M ' 20' ' ' ARG . . . . . . . . . . . . . 48.7 ttp180 -52.01 -30.14 23.96 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.154 -0.475 . . . . 73.420000000000002 110.851 179.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' M' M ' 21' ' ' LEU . . . . . . . . . . . . . 6.9 mt 57.68 -175.98 0.07 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.194 -0.457 . . . . 71.010000000000005 110.908 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' M' M ' 22' ' ' ARG . . . . . . . . . . . . . 6.7 ptt180 -157.75 65.88 3.44 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 121.556 0.693 . . . . 75.200000000000003 110.875 179.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' M' M ' 23' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.77 -40.3 5.47 Favored 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.663 2.242 . . . . 72.310000000000002 112.351 -179.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' M' M ' 24' ' ' GLY . . . . . . . . . . . . . . . 84.47 50.08 4.39 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.76 -0.733 . . . . 63.100000000000001 112.517 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' M' M ' 25' ' ' GLY . . . . . . . . . . . . . . . -52.23 171.43 0.4 Allowed Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.733 -0.746 . . . . 63.130000000000003 112.539 -179.907 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' M' M ' 26' ' ' LYS . . . . . . . . . . . . . 8.5 pttm -172.61 35.14 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.889 0.376 . . . . 72.340000000000003 110.888 179.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' M' M ' 27' ' ' LYS . . . . . . . . . . . . . 30.7 tttm -175.02 112.82 0.14 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.233 -0.44 . . . . 74.420000000000002 110.924 179.869 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' M' M ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -108.13 -33.54 7.13 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.232 -0.44 . . . . 75.310000000000002 110.938 179.976 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' M' M ' 29' ' ' TYR . . . . . . . . . . . . . 9.3 m-85 -62.36 120.98 12.07 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.156 -0.475 . . . . 64.25 110.922 -179.865 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' M' M ' 30' ' ' LYS . . . . . . . . . . . . . 2.1 ptmt -95.87 27.24 3.63 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.13 -0.486 . . . . 73.349999999999994 110.864 179.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' M' M ' 31' ' ' LEU . . . . . . . . . . . . . 10.0 tp -118.87 -31.38 4.8 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.233 -0.439 . . . . 73.519999999999996 110.945 179.937 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' M' M ' 32' ' ' LYS . . . . . . . . . . . . . 5.4 mtpm? -49.89 -44.61 50.08 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.155 -0.475 . . . . 75.409999999999997 110.89 179.821 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' M' M ' 33' ' ' HIS . . . . . . . . . . . . . 3.6 t60 -50.71 -37.31 40.72 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.272 -0.422 . . . . 73.329999999999998 110.839 179.909 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' M' M ' 34' ' ' ILE . . . . . . . . . . . . . 49.3 mm -50.27 -39.65 16.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.197 -0.456 . . . . 65.519999999999996 111.12 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' M' M ' 35' ' ' VAL . . . . . . . . . . . . . 40.1 t -49.31 -39.95 13.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.159 -0.473 . . . . 74.219999999999999 111.123 179.876 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' M' M ' 36' ' ' TRP . . . . . . . . . . . . . 24.8 m0 -58.78 -39.45 81.07 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.173 -0.467 . . . . 75.230000000000004 110.96 179.964 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' M' M ' 37' ' ' ALA . . . . . . . . . . . . . . . -64.1 -18.62 64.57 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.257 -0.429 . . . . 74.299999999999997 111.084 179.851 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' M' M ' 38' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -73.29 -17.92 61.26 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.227 -0.442 . . . . 74.150000000000006 110.877 -179.782 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' M' M ' 39' ' ' ARG . . . . . . . . . . . . . 22.5 mmm180 -62.76 -25.18 68.08 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.149 -0.478 . . . . 73.219999999999999 110.837 -179.94 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' M' M ' 40' ' ' GLU . . . . . . . . . . . . . 7.0 mp0 -77.21 -48.03 18.66 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.211 -0.45 . . . . 73.400000000000006 110.898 -179.917 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' M' M ' 41' ' ' LEU . . . . . . . . . . . . . 18.0 mt -54.77 133.95 47.55 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.103 -0.499 . . . . 73.409999999999997 110.904 -179.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' M' M ' 42' ' ' GLU . . . . . . . . . . . . . 13.4 tp10 -105.28 138.57 41.28 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.166 -0.47 . . . . 74.439999999999998 110.868 179.989 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' M' M ' 43' ' ' ARG . . . . . . . . . . . . . 47.7 mtp180 . . . . . 0 C--N 1.329 -0.299 0 CA-C-N 116.164 -0.471 . . . . 72.400000000000006 110.855 -179.888 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 241' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 262' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 301' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 322' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.457 -0.086 0 CA-C-O 120.813 0.34 . . . . 73.340000000000003 111.142 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 21.9 t0 -84.96 142.56 29.56 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.202 -0.453 . . . . 73.430000000000007 110.876 179.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 64.1 mt-30 -154.66 154.26 32.65 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.24 -0.436 . . . . 74.150000000000006 110.872 -179.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 19.4 mt -105.15 151.57 23.87 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.166 -0.47 . . . . 64.329999999999998 110.944 179.97 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 57.8 p -119.12 173.12 7.1 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.172 -0.467 . . . . 74.430000000000007 111.164 179.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 11.1 tt0 -52.89 -29.29 27.49 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.263 -0.426 . . . . 62.409999999999997 110.853 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 33.1 tp10 -67.16 -41.6 85.71 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.174 -0.467 . . . . 72.129999999999995 110.895 -179.929 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 19.3 tt0 -77.73 -39.25 45.07 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.129 -0.487 . . . . 74.209999999999994 110.864 -179.886 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 64.2 mt -69.84 -37.23 72.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.186 -0.461 . . . . 74.25 111.139 179.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -52.16 -50.81 61.06 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.203 -0.453 . . . . 75.209999999999994 111.097 179.831 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 17.5 mt-10 -57.02 -52.22 66.14 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.187 -0.46 . . . . 74.010000000000005 110.847 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 45.7 m-85 -58.02 -42.36 85.09 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.206 -0.452 . . . . 75.129999999999995 110.879 -179.907 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 21.7 ttpp -51.88 -41.26 61.77 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.114 -0.494 . . . . 74.140000000000001 110.932 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 56.5 tt0 -62.81 -32.87 74.15 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.261 -0.427 . . . . 74.510000000000005 110.829 180.0 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -68.91 -37.63 79.07 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.15 -0.477 . . . . 74.310000000000002 111.062 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 89.8 t80 -69.96 -53.22 18.77 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.257 -0.429 . . . . 75.310000000000002 110.912 -179.911 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 1.7 t -52.04 -35.79 48.3 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.153 -0.476 . . . . 71.230000000000004 110.855 -179.824 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 18.7 tp -59.81 -45.71 91.48 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.129 -0.487 . . . . 73.540000000000006 110.931 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 20.8 m-85 -73.07 -34.08 66.02 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.193 -0.458 . . . . 74.019999999999996 110.88 179.911 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 9.6 t0 -76.37 98.43 4.53 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.175 -0.466 . . . . 72.420000000000002 110.897 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 3.0 ttmp? -71.38 -55.73 7.39 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.188 -0.46 . . . . 75.209999999999994 110.903 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 22.3 p-10 -74.82 -10.04 59.12 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.227 -0.442 . . . . 74.409999999999997 110.863 179.867 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 52.25 44.26 57.67 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.732 -0.747 . . . . 72.040000000000006 112.486 -179.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 35.7 p-10 -89.58 -15.8 32.05 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.88 0.371 . . . . 72.140000000000001 110.893 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 103.92 -11.63 52.67 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.716 -0.754 . . . . 71.409999999999997 112.501 -179.906 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 19.8 p -128.01 133.26 49.13 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.736 0.303 . . . . 72.409999999999997 111.144 -179.866 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 24.5 mt -103.94 111.54 33.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.22 -0.445 . . . . 74.140000000000001 111.119 179.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 20.3 p -94.81 -179.73 4.95 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.158 -0.474 . . . . 75.310000000000002 111.138 179.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 65.3 p -61.05 -32.04 71.67 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.185 -0.461 . . . . 75.349999999999994 111.164 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 24.1 tptm -68.31 -50.11 55.76 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.18 -0.463 . . . . 75.129999999999995 110.921 179.867 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -70.33 -32.7 70.55 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.208 -0.451 . . . . 63.509999999999998 110.907 179.937 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -74.14 -41.2 61.93 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.145 -0.48 . . . . 73.409999999999997 110.917 -179.963 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -71.72 -41.01 57.57 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.738 -0.744 . . . . 73.510000000000005 112.478 179.902 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 97.3 m -56.69 -56.43 21.47 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.82 0.343 . . . . 73.549999999999997 111.079 -179.839 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 91.9 t -52.01 -44.78 39.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.227 -0.442 . . . . 74.349999999999994 111.117 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 6.1 mmm -56.38 -34.46 66.7 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.173 -0.467 . . . . 74.430000000000007 110.913 179.874 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 35.9 ttp85 -57.53 -55.26 37.12 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.195 -0.457 . . . . 74.430000000000007 110.899 -179.912 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 3.4 t -59.09 -27.0 65.15 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.205 -0.452 . . . . 75.430000000000007 110.842 -179.825 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 55.7 mt -78.98 -16.46 56.9 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.176 -0.466 . . . . 64.420000000000002 110.957 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 101.55 26.38 7.69 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.751 -0.738 . . . . 41.210000000000001 112.461 179.881 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 17.3 mt-30 -133.38 123.06 24.7 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.801 0.334 . . . . 74.140000000000001 110.92 -179.878 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 2.0 t30 -109.82 76.9 0.99 Allowed Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.6 0.714 . . . . 71.150000000000006 110.9 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.79 161.81 44.51 Favored 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.651 2.234 . . . . 75.329999999999998 112.344 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 34.1 p -100.14 168.74 9.62 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.195 -0.457 . . . . 74.430000000000007 111.12 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 4.4 mp0 -54.43 -51.1 66.0 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.171 -0.468 . . . . 75.310000000000002 110.861 -179.972 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -67.28 -31.5 71.87 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.174 -0.467 . . . . 71.430000000000007 111.143 179.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -65.35 -46.77 78.87 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.199 -0.455 . . . . 73.129999999999995 110.866 -179.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 18.3 mt -67.78 -51.9 43.48 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.188 -0.46 . . . . 74.200000000000003 110.922 -179.964 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 12.5 tp60 -52.91 -28.49 23.59 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.217 -0.447 . . . . 71.319999999999993 110.962 179.901 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -64.42 -49.83 70.0 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.159 -0.473 . . . . 71.329999999999998 110.888 179.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 6.1 ptp -76.35 -35.71 58.57 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.175 -0.466 . . . . 62.229999999999997 110.882 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 81.8 mt -66.09 -38.35 81.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.205 -0.452 . . . . 70.140000000000001 111.138 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 28.0 m-20 -63.59 -43.23 97.55 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.125 -0.489 . . . . 74.349999999999994 110.836 179.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -57.9 -43.54 86.23 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.204 -0.453 . . . . 73.140000000000001 110.856 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 36.0 m -81.56 -13.14 12.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.197 -0.456 . . . . 74.430000000000007 111.124 179.977 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 38.2 t0 -66.89 97.61 0.49 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.198 -0.456 . . . . 73.439999999999998 110.82 179.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.19 -44.31 10.98 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.156 -0.475 . . . . 73.549999999999997 111.132 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 9.3 p-10 -81.74 -0.17 41.76 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.207 -0.451 . . . . 74.219999999999999 110.837 179.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 54.51 57.37 17.7 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.716 -0.754 . . . . 70.400000000000006 112.507 -179.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 52.1 p-10 -114.53 -15.81 11.97 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.859 0.361 . . . . 63.43 110.852 -179.848 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 93.82 15.89 47.39 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.744 -0.741 . . . . 72.120000000000005 112.453 179.963 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 44.6 p -148.84 175.34 11.34 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.763 0.316 . . . . 73.120000000000005 111.13 -179.857 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 19.2 mt -107.84 109.78 29.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.197 -0.456 . . . . 74.010000000000005 111.161 179.897 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.4 t0 -75.28 -172.93 1.88 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.181 -0.463 . . . . 75.409999999999997 110.818 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.515 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 2.5 t80 -65.29 -58.28 12.68 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-O 121.635 0.731 . . . . 75.140000000000001 110.888 -179.933 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . 0.515 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 53.6 Cg_endo -69.76 -26.42 27.6 Favored 'Trans proline' 0 C--N 1.341 0.146 0 C-N-CA 122.649 2.233 . . . . 74.430000000000007 112.364 -179.994 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 20.3 mt-10 -62.07 -40.57 96.26 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.199 -0.455 . . . . 75.109999999999999 110.891 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 17.2 t80 -74.36 -35.86 63.57 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.158 -0.474 . . . . 75.099999999999994 110.903 -179.925 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 33.6 tp -69.92 -53.9 15.79 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.098 -0.501 . . . . 64.340000000000003 110.916 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 14.0 t -53.29 -30.69 40.1 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.175 -0.466 . . . . 73.25 111.155 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 36.2 ttp -58.79 -50.62 73.27 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.222 -0.444 . . . . 74.030000000000001 110.856 179.956 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 1.4 mmt -66.08 -48.81 69.74 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.263 -0.426 . . . . 72.230000000000004 110.891 179.932 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -55.31 -28.65 55.06 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.262 -0.426 . . . . 72.409999999999997 111.055 179.904 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 23.3 ttm180 -64.71 -20.06 66.11 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.219 -0.446 . . . . 73.409999999999997 110.875 -179.866 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 8.5 ptmm? -51.66 -30.29 21.17 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.165 -0.471 . . . . 73.239999999999995 110.885 179.963 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 1.3 tpt -52.0 -35.67 47.37 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.27 -0.423 . . . . 72.299999999999997 110.872 179.9 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -175.92 139.42 0.39 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.183 -0.462 . . . . 75.209999999999994 110.898 179.959 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -168.26 -74.81 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.202 -0.454 . . . . 73.010000000000005 110.882 179.88 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -164.21 176.69 8.98 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.188 -0.46 . . . . 62.020000000000003 111.149 -179.968 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -165.65 -74.41 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.192 -0.458 . . . . 75.040000000000006 110.859 179.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 89.0 p -77.26 -51.54 10.73 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.167 -0.469 . . . . 74.129999999999995 110.858 -179.724 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -55.04 -26.74 39.43 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.09 -0.505 . . . . 74.439999999999998 110.859 -179.932 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 12.9 tt0 -70.35 -52.8 19.99 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.188 -0.46 . . . . 73.109999999999999 110.869 -179.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 24.6 tp10 -69.39 -48.08 62.24 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.158 -0.473 . . . . 62.109999999999999 110.925 -179.964 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 56.3 mt -55.26 -46.83 78.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.127 -0.488 . . . . 75.420000000000002 111.08 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 44.8 ttp180 -53.99 -33.49 57.2 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.188 -0.46 . . . . 75.010000000000005 110.843 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 28.2 tt0 -76.63 -57.45 3.85 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.215 -0.448 . . . . 73.340000000000003 110.858 -179.879 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -53.53 -48.54 68.96 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.15 -0.477 . . . . 61.140000000000001 111.113 179.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 7.0 t80 -52.02 -51.26 58.57 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.21 -0.45 . . . . 71.120000000000005 110.855 -179.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 2.1 tmt_? -62.52 -46.95 86.05 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.166 -0.47 . . . . 74.420000000000002 110.891 -179.892 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 87.8 t -51.88 -47.91 40.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.189 -0.46 . . . . 72.040000000000006 111.143 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 18.6 m-85 -73.57 -26.48 60.85 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.148 -0.478 . . . . 71.239999999999995 110.889 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 31.6 t0 -69.77 95.2 0.87 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.118 -0.492 . . . . 73.5 110.854 179.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -78.65 -52.51 8.33 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.188 -0.46 . . . . 74.319999999999993 110.89 -179.998 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 53.6 p30 -72.66 -9.16 58.28 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.213 -0.448 . . . . 61.539999999999999 110.862 179.91 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 59.87 28.0 65.24 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.711 -0.757 . . . . 53.25 112.492 -179.955 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 46.0 p-10 -82.08 -16.14 51.06 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.871 0.367 . . . . 64.040000000000006 110.894 -179.859 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 88.1 18.66 55.39 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.743 -0.742 . . . . 25.539999999999999 112.507 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 12.9 m-85 -138.89 151.98 47.39 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.862 0.363 . . . . 74.409999999999997 110.911 -179.782 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 70.8 mt -115.73 122.34 69.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.154 -0.476 . . . . 65.439999999999998 111.167 179.907 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 53.4 p -114.81 -172.58 2.15 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.191 -0.459 . . . . 74.319999999999993 110.871 -179.877 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -74.75 -39.77 61.64 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.179 -0.464 . . . . 74.219999999999999 111.154 179.872 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -62.72 -39.98 95.77 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.188 -0.46 . . . . 75.450000000000003 111.09 179.906 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 21.6 mt-10 -76.95 -46.75 23.05 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.217 -0.447 . . . . 75.319999999999993 110.863 -179.89 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 29.7 tp -53.16 -43.97 67.46 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.136 -0.484 . . . . 74.400000000000006 110.926 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 21.7 ttt-85 -51.99 -39.13 58.92 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.175 -0.466 . . . . 70.319999999999993 110.868 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 16.3 t60 -63.3 -35.53 80.67 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.192 -0.458 . . . . 70.120000000000005 110.847 -179.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 90.7 t -70.04 -52.29 32.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.218 -0.446 . . . . 75.099999999999994 111.143 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 1.6 mmt -61.46 -44.68 96.67 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.172 -0.467 . . . . 74.109999999999999 110.849 179.906 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 12.9 p -53.01 -32.78 48.5 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.249 -0.432 . . . . 72.439999999999998 111.17 -179.871 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 8.9 t30 -74.62 -31.01 61.86 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.209 -0.451 . . . . 72.040000000000006 110.868 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 1.1 tt -70.7 -26.07 63.25 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.193 -0.458 . . . . 72.5 110.925 179.966 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 100.12 23.28 10.69 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.758 -0.734 . . . . 71.019999999999996 112.468 179.928 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 54.7 tp10 -104.3 115.58 30.63 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.894 0.378 . . . . 75.329999999999998 110.88 -179.861 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 14.0 pttp -64.82 117.77 8.01 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.156 -0.475 . . . . 75.030000000000001 110.884 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 17.2 mt -146.75 130.66 17.16 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.196 -0.456 . . . . 73.430000000000007 110.912 179.901 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 32.6 p -92.13 170.9 9.46 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.162 -0.472 . . . . 71.120000000000005 111.193 179.964 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 60.3 m-20 -53.24 -43.37 67.28 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.262 -0.426 . . . . 74.0 110.909 179.867 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 16.5 tp10 -65.55 -35.02 79.62 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.187 -0.461 . . . . 73.310000000000002 110.837 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 2.2 tp10 -65.97 -40.72 91.5 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.178 -0.464 . . . . 71.439999999999998 110.859 -179.875 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 30.6 t -61.29 -38.94 80.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.147 -0.479 . . . . 74.019999999999996 111.164 179.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -52.02 -48.92 64.27 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.138 -0.483 . . . . 73.400000000000006 110.836 179.946 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -56.22 -29.3 60.78 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.203 -0.453 . . . . 74.140000000000001 110.859 -179.905 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -73.37 -59.62 2.62 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.191 -0.459 . . . . 65.239999999999995 110.831 179.997 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 33.0 mm -54.06 -35.81 29.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.238 -0.437 . . . . 64.129999999999995 111.134 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 69.2 ttt180 -63.44 -31.77 73.03 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.163 -0.471 . . . . 73.230000000000004 110.921 179.906 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 6.7 tp10 -71.43 -44.34 65.04 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.21 -0.45 . . . . 74.099999999999994 110.934 -179.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -76.06 -26.58 56.68 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.113 -0.494 . . . . 72.019999999999996 111.085 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 43.1 t0 -68.04 87.52 0.26 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.189 -0.46 . . . . 74.420000000000002 110.88 179.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 60.8 mt -79.91 -49.33 19.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.175 -0.466 . . . . 73.310000000000002 111.126 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 18.8 p30 -72.91 -8.7 56.82 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.167 -0.47 . . . . 72.200000000000003 110.841 179.842 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 63.9 44.67 95.73 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.751 -0.738 . . . . 71.200000000000003 112.521 -179.907 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 35.8 p-10 -91.18 -15.88 28.6 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.884 0.373 . . . . 72.030000000000001 110.862 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 104.19 2.33 44.86 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.758 -0.734 . . . . 72.120000000000005 112.457 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 7.2 tt0 -149.19 172.2 15.22 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.775 0.321 . . . . 60.409999999999997 110.935 -179.9 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 136' ' ' VAL . . . . . . . . . . . . . 61.6 t -105.63 109.74 28.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.176 -0.466 . . . . 74.310000000000002 111.142 179.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 23.1 p30 -89.09 165.46 14.49 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.167 -0.47 . . . . 72.030000000000001 110.934 179.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 87.1 t80 -52.05 -47.2 65.21 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.158 -0.474 . . . . 72.310000000000002 110.921 -179.898 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -52.01 -37.98 55.21 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.144 -0.48 . . . . 64.340000000000003 110.881 179.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 19.4 mt-10 -78.39 -47.72 17.03 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.149 -0.478 . . . . 75.129999999999995 110.875 -179.906 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 65.2 t80 -54.33 -36.24 63.55 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.152 -0.476 . . . . 74.120000000000005 110.912 -179.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 90.0 t -70.81 -43.04 77.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.147 -0.479 . . . . 73.450000000000003 111.16 179.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 20.5 tt0 -68.35 -29.98 68.83 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.162 -0.472 . . . . 73.439999999999998 110.872 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 7.9 tpt -72.03 -56.6 5.35 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.254 -0.43 . . . . 64.099999999999994 110.897 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 9.7 ttm -65.91 -26.06 67.44 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.256 -0.429 . . . . 71.230000000000004 110.891 179.927 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 2.1 m -108.29 21.28 17.55 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.238 -0.437 . . . . 73.329999999999998 111.135 -179.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -51.74 127.37 20.5 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.234 -0.439 . . . . 65.010000000000005 111.145 179.826 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 9.9 mmmt . . . . . 0 C--N 1.329 -0.301 0 CA-C-N 116.205 -0.452 . . . . 75.409999999999997 110.895 179.996 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' M' M ' 8' ' ' LEU . . . . . . . . . . . . . 17.4 mt . . . . . 0 C--O 1.232 0.142 0 CA-C-O 120.844 0.354 . . . . 74.129999999999995 110.868 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' M' M ' 9' ' ' SER . . . . . . . . . . . . . 74.0 m -137.16 168.37 19.74 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.167 -0.47 . . . . 75.329999999999998 110.866 -179.957 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' M' M ' 10' ' ' GLY . . . . . . . . . . . . . . . 148.84 54.04 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.805 -0.712 . . . . 52.140000000000001 112.509 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' M' M ' 11' ' ' GLY . . . . . . . . . . . . . . . 154.39 -126.75 1.96 Allowed Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.762 -0.732 . . . . 65.319999999999993 112.454 -179.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' M' M ' 12' ' ' GLU . . . . . . . . . . . . . 13.4 mm-40 57.19 94.06 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.886 0.374 . . . . 73.319999999999993 110.845 -179.85 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' M' M ' 13' ' ' LEU . . . . . . . . . . . . . 35.4 tp -52.66 125.41 16.52 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.198 -0.456 . . . . 75.319999999999993 110.909 -179.966 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' M' M ' 14' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -72.16 -30.46 65.01 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.16 -0.473 . . . . 71.010000000000005 110.879 179.858 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' M' M ' 15' ' ' LYS . . . . . . . . . . . . . 20.4 mtmm -54.6 -50.77 67.27 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.212 -0.449 . . . . 74.030000000000001 110.877 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' M' M ' 16' ' ' TRP . . . . . . . . . . . . . 26.4 m95 -52.28 -43.13 64.27 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.242 -0.435 . . . . 71.219999999999999 110.899 179.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' M' M ' 17' ' ' GLU . . . . . . . . . . . . . 24.5 tt0 -54.48 -27.52 38.39 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.223 -0.444 . . . . 72.129999999999995 110.903 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' M' M ' 18' ' ' LYS . . . . . . . . . . . . . 15.8 ttpt -69.7 -30.6 68.27 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.157 -0.474 . . . . 72.140000000000001 110.899 179.961 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' M' M ' 19' ' ' ILE . . . . . . . . . . . . . 43.9 mt -80.91 -25.02 10.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.22 -0.445 . . . . 74.129999999999995 111.13 179.867 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' M' M ' 20' ' ' ARG . . . . . . . . . . . . . 31.9 ttm180 -53.28 -28.79 29.7 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.206 -0.452 . . . . 71.420000000000002 110.881 179.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' M' M ' 21' ' ' LEU . . . . . . . . . . . . . 9.5 mt 58.0 178.73 0.06 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.207 -0.451 . . . . 75.340000000000003 110.922 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' M' M ' 22' ' ' ARG . . . . . . . . . . . . . 13.0 ptm180 -179.29 57.15 0.09 OUTLIER Pre-proline 0 C--N 1.328 -0.358 0 CA-C-O 121.634 0.73 . . . . 74.450000000000003 110.902 179.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' M' M ' 23' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.73 -171.55 0.48 Allowed 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.702 2.268 . . . . 72.140000000000001 112.32 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' M' M ' 24' ' ' GLY . . . . . . . . . . . . . . . -146.03 19.57 1.76 Allowed Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.714 -0.755 . . . . 70.329999999999998 112.5 179.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' M' M ' 25' ' ' GLY . . . . . . . . . . . . . . . -169.95 28.08 0.12 Allowed Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.741 -0.742 . . . . 72.340000000000003 112.462 -179.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' M' M ' 26' ' ' LYS . . . . . . . . . . . . . 2.3 mmpt? -117.6 26.1 9.95 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.861 0.362 . . . . 75.5 110.874 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' M' M ' 27' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.05 172.05 19.14 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.228 -0.442 . . . . 74.25 110.908 179.818 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' M' M ' 28' ' ' GLN . . . . . . . . . . . . . 4.9 tt0 62.41 173.19 0.14 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.215 -0.448 . . . . 74.400000000000006 110.885 179.956 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' M' M ' 29' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -67.51 92.71 0.32 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.207 -0.451 . . . . 75.450000000000003 110.895 -179.821 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' M' M ' 30' ' ' LYS . . . . . . . . . . . . . 12.0 tttp -58.06 -22.84 52.13 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.123 -0.489 . . . . 74.5 110.867 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' M' M ' 31' ' ' LEU . . . . . . . . . . . . . 14.2 tp -70.62 -44.63 66.83 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.254 -0.43 . . . . 71.530000000000001 110.921 179.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' M' M ' 32' ' ' LYS . . . . . . . . . . . . . 5.7 mtmt -48.63 -44.87 37.73 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.182 -0.463 . . . . 75.450000000000003 110.894 179.851 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' M' M ' 33' ' ' HIS . . . . . . . . . . . . . 73.9 t60 -50.39 -39.33 46.65 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.227 -0.442 . . . . 74.510000000000005 110.843 179.898 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' M' M ' 34' ' ' ILE . . . . . . . . . . . . . 66.0 mt -50.6 -39.37 17.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.204 -0.453 . . . . 75.129999999999995 111.157 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' M' M ' 35' ' ' VAL . . . . . . . . . . . . . 39.8 t -49.36 -39.8 13.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.179 -0.464 . . . . 74.140000000000001 111.121 179.861 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' M' M ' 36' ' ' TRP . . . . . . . . . . . . . 24.2 m0 -58.71 -39.69 81.53 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.182 -0.463 . . . . 75.420000000000002 110.918 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' M' M ' 37' ' ' ALA . . . . . . . . . . . . . . . -63.87 -18.72 64.45 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.256 -0.429 . . . . 71.310000000000002 111.113 179.829 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' M' M ' 38' ' ' SER . . . . . . . . . . . . . 1.2 m -70.71 -17.91 62.81 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.266 -0.425 . . . . 73.530000000000001 110.873 -179.801 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' M' M ' 39' ' ' ARG . . . . . . . . . . . . . 37.2 mtp180 -53.29 -28.62 28.95 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.129 -0.487 . . . . 75.120000000000005 110.88 -179.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' M' M ' 40' ' ' GLU . . . . . . . . . . . . . 16.0 tp10 -85.98 -47.97 9.11 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.151 -0.477 . . . . 74.329999999999998 110.864 -179.912 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' M' M ' 41' ' ' LEU . . . . . . . . . . . . . 10.5 mt -64.71 137.94 58.1 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.152 -0.476 . . . . 75.230000000000004 110.947 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' M' M ' 42' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -143.81 104.74 4.21 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.233 -0.44 . . . . 72.120000000000005 110.901 179.977 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' M' M ' 43' ' ' ARG . . . . . . . . . . . . . 60.1 mtp180 . . . . . 0 C--N 1.328 -0.332 0 CA-C-N 116.169 -0.469 . . . . 74.129999999999995 110.875 -179.887 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 241' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 262' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 301' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 322' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.087 0 CA-C-O 120.836 0.351 . . . . 71.340000000000003 111.101 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 10.9 p-10 -138.33 39.72 2.27 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.195 -0.457 . . . . 62.030000000000001 110.871 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 11.8 pt20 -170.41 150.91 3.59 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.192 -0.458 . . . . 73.340000000000003 110.91 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 11.4 mt -80.15 140.17 36.49 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.169 -0.469 . . . . 73.219999999999999 110.96 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 71.4 p -99.34 174.26 6.38 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.268 -0.424 . . . . 74.310000000000002 111.098 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 21.5 tt0 -55.29 -31.53 61.69 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.218 -0.447 . . . . 73.439999999999998 110.858 -179.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -67.65 -27.88 67.24 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.163 -0.472 . . . . 71.209999999999994 110.898 -179.911 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -78.0 -46.37 21.2 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.128 -0.487 . . . . 75.099999999999994 110.86 -179.916 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 3.3 mp -72.19 -40.06 65.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.21 -0.45 . . . . 75.409999999999997 111.138 179.977 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -53.59 -32.09 49.6 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.215 -0.448 . . . . 75.420000000000002 111.057 179.831 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 27.3 mm-40 -74.79 -52.18 12.15 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.271 -0.422 . . . . 64.329999999999998 110.888 -179.894 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 38.1 m-85 -59.55 -45.97 90.24 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.134 -0.485 . . . . 74.420000000000002 110.889 -179.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 33.0 ttpt -53.87 -35.8 61.96 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.134 -0.485 . . . . 74.150000000000006 110.872 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -65.11 -30.85 71.82 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.269 -0.423 . . . . 75.420000000000002 110.913 179.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -70.68 -48.29 55.5 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.158 -0.474 . . . . 74.519999999999996 111.069 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 89.5 t80 -55.65 -54.24 46.59 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.221 -0.445 . . . . 73.030000000000001 110.887 -179.91 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 27.7 t -53.92 -29.56 42.67 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.109 -0.496 . . . . 74.219999999999999 110.874 -179.792 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 15.6 tp -65.72 -44.32 86.41 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.094 -0.503 . . . . 74.019999999999996 110.914 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 56.0 m-85 -75.71 -25.89 57.04 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.153 -0.476 . . . . 75.530000000000001 110.888 179.935 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 12.8 t0 -79.53 98.53 6.88 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.16 -0.473 . . . . 64.310000000000002 110.889 179.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 10.4 ttpp -67.11 -50.75 60.4 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.216 -0.447 . . . . 75.200000000000003 110.903 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 24.0 p-10 -81.0 -10.16 59.75 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.206 -0.452 . . . . 74.420000000000002 110.919 179.847 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 51.73 42.48 52.61 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.728 -0.749 . . . . 53.100000000000001 112.457 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 22.9 p-10 -88.51 -15.79 34.36 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.85 0.357 . . . . 74.109999999999999 110.854 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 102.18 17.64 19.65 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.715 -0.755 . . . . 42.409999999999997 112.477 -179.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -154.64 130.79 10.31 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.777 0.322 . . . . 73.430000000000007 111.127 -179.866 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 23.5 mt -97.73 122.38 49.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.167 -0.469 . . . . 72.219999999999999 111.12 179.915 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 21.4 p -105.48 176.72 5.07 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.166 -0.47 . . . . 63.130000000000003 111.142 179.958 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 72.3 p -61.18 -29.34 69.74 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.239 -0.437 . . . . 71.140000000000001 111.129 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 28.4 mmtp -72.7 -49.97 27.9 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.202 -0.454 . . . . 73.140000000000001 110.883 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -68.93 -32.68 72.48 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.21 -0.45 . . . . 75.030000000000001 110.896 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -71.52 -43.35 66.62 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.134 -0.484 . . . . 70.129999999999995 110.882 -179.978 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -70.26 -28.14 71.84 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.73 -0.747 . . . . 53.329999999999998 112.492 179.903 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 92.9 m -71.91 -58.21 3.65 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.826 0.346 . . . . 64.400000000000006 111.114 -179.851 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 96.0 t -51.62 -49.46 34.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.252 -0.431 . . . . 73.430000000000007 111.09 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 6.4 ttt -60.33 -39.31 86.6 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.199 -0.455 . . . . 72.430000000000007 110.868 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 51.4 ttp85 -52.74 -43.2 65.58 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.243 -0.435 . . . . 73.040000000000006 110.891 -179.944 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.7 t -70.28 -25.23 63.24 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.222 -0.445 . . . . 75.099999999999994 110.861 -179.8 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 57.1 mt -76.15 -20.92 57.14 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.108 -0.496 . . . . 74.109999999999999 110.932 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 101.48 30.01 6.07 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.771 -0.728 . . . . 71.150000000000006 112.511 179.916 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 15.4 mm-40 -128.9 122.56 30.54 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.829 0.347 . . . . 73.409999999999997 110.882 -179.897 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 33.7 t-20 -109.93 80.68 1.82 Allowed Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.589 0.709 . . . . 54.219999999999999 110.89 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.74 168.03 22.71 Favored 'Trans proline' 0 C--O 1.231 0.158 0 C-N-CA 122.671 2.247 . . . . 73.109999999999999 112.346 179.937 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 18.0 p -93.05 158.74 15.63 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.187 -0.46 . . . . 75.329999999999998 111.105 -179.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.3 pt-20 -51.66 -45.0 63.23 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.197 -0.456 . . . . 74.430000000000007 110.893 179.993 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -72.29 -31.32 65.62 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.16 -0.473 . . . . 70.420000000000002 111.088 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -69.98 -42.23 73.38 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.208 -0.451 . . . . 74.209999999999994 110.838 -179.853 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 15.1 mt -59.57 -50.98 71.79 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.187 -0.46 . . . . 71.219999999999999 110.932 179.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -71.91 -28.36 63.43 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.186 -0.461 . . . . 65.209999999999994 110.94 179.923 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 7.8 t0 -56.49 -49.8 73.64 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.18 -0.464 . . . . 74.400000000000006 110.813 179.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 6.7 ptp -69.49 -37.67 77.34 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.216 -0.447 . . . . 74.239999999999995 110.895 -179.957 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 96.5 mt -62.08 -52.48 59.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.191 -0.458 . . . . 73.409999999999997 111.126 179.928 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -55.06 -32.95 62.31 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.17 -0.468 . . . . 64.319999999999993 110.857 179.952 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -60.4 -55.29 35.36 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.185 -0.461 . . . . 74.129999999999995 110.852 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 17.2 m -77.12 -13.1 14.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.215 -0.448 . . . . 74.140000000000001 111.108 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 41.9 t0 -66.74 96.39 0.4 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.192 -0.458 . . . . 70.129999999999995 110.879 179.916 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.25 -36.81 16.52 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.217 -0.447 . . . . 71.319999999999993 111.08 179.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -86.45 -0.23 55.57 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.177 -0.465 . . . . 74.540000000000006 110.894 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 51.93 60.99 6.89 Favored Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.747 -0.739 . . . . 75.5 112.52 -179.946 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 51.5 p-10 -114.61 -15.89 11.92 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.814 0.34 . . . . 74.430000000000007 110.841 -179.822 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 93.82 17.93 39.48 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.709 -0.758 . . . . 74.120000000000005 112.446 179.941 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 70.0 p -151.07 174.29 13.35 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.758 0.313 . . . . 74.040000000000006 111.146 -179.819 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 22.6 mt -104.84 110.93 32.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.279 -0.419 . . . . 75.329999999999998 111.163 179.897 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -75.12 -172.98 1.84 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.219 -0.446 . . . . 74.010000000000005 110.873 179.874 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.524 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 2.5 t80 -65.52 -58.31 12.18 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-O 121.644 0.735 . . . . 74.409999999999997 110.947 -179.916 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . 0.524 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 53.7 Cg_endo -69.77 -26.98 27.0 Favored 'Trans proline' 0 C--N 1.341 0.16 0 C-N-CA 122.636 2.224 . . . . 74.329999999999998 112.38 179.962 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -60.91 -41.41 96.04 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.186 -0.461 . . . . 75.349999999999994 110.879 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 8.3 t80 -74.58 -35.72 63.03 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.154 -0.476 . . . . 74.239999999999995 110.909 -179.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 18.6 tp -68.76 -54.13 17.82 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.113 -0.494 . . . . 74.409999999999997 110.903 -179.976 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 14.6 t -52.97 -28.18 22.55 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.183 -0.462 . . . . 73.329999999999998 111.141 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 43.2 ttp -64.92 -48.35 74.45 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.239 -0.437 . . . . 74.239999999999995 110.885 179.881 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -63.34 -38.21 90.26 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.248 -0.433 . . . . 73.439999999999998 110.876 179.944 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -74.8 -28.71 60.83 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.268 -0.424 . . . . 65.209999999999994 111.098 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 5.1 ttp180 -66.12 -18.98 65.69 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.249 -0.432 . . . . 75.099999999999994 110.862 -179.913 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 13.2 pttm -51.2 -30.76 18.15 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.195 -0.457 . . . . 74.439999999999998 110.886 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 25.0 tpp -53.82 -57.59 10.36 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.231 -0.441 . . . . 72.549999999999997 110.87 179.855 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 12.6 ttmt -172.58 176.25 3.28 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.257 -0.429 . . . . 75.230000000000004 110.9 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 12.8 m-20 63.4 80.91 0.22 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.196 -0.456 . . . . 73.420000000000002 110.848 179.868 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 14.6 t -163.8 26.75 0.08 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.209 -0.45 . . . . 74.140000000000001 111.139 -179.897 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -116.04 -25.08 7.79 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.211 -0.449 . . . . 64.510000000000005 110.84 179.911 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 83.7 p -62.87 -27.17 69.16 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.241 -0.436 . . . . 75.420000000000002 110.854 -179.778 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -98.13 -30.12 12.84 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.182 -0.463 . . . . 74.209999999999994 110.862 -179.926 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 13.1 tt0 -74.2 -45.47 48.09 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.16 -0.473 . . . . 72.150000000000006 110.871 -179.936 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -55.51 -35.38 65.55 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.179 -0.464 . . . . 74.129999999999995 110.877 -179.908 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 78.8 mt -63.35 -46.07 96.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.178 -0.464 . . . . 75.140000000000001 111.109 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.79 -53.34 13.68 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.182 -0.463 . . . . 75.510000000000005 110.889 179.97 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 11.6 tt0 -51.9 -46.37 64.54 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.205 -0.452 . . . . 72.219999999999999 110.874 -179.942 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -56.18 -41.44 75.52 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.182 -0.463 . . . . 74.219999999999999 111.08 179.936 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 9.4 t80 -54.74 -36.47 64.82 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.256 -0.429 . . . . 74.239999999999995 110.863 -179.899 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.76 -47.09 64.25 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.114 -0.494 . . . . 72.340000000000003 110.86 -179.888 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 84.5 t -53.22 -28.6 15.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.204 -0.453 . . . . 71.150000000000006 111.13 179.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 9.4 m-85 -94.9 -28.2 15.32 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.149 -0.478 . . . . 71.540000000000006 110.852 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 37.9 t0 -81.48 81.72 7.51 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.169 -0.469 . . . . 63.140000000000001 110.848 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 4.5 mptp? -76.46 -43.78 38.43 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.228 -0.442 . . . . 75.409999999999997 110.87 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 10.0 p30 -72.87 -9.14 58.36 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.215 -0.448 . . . . 63.219999999999999 110.837 179.888 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 60.34 30.67 71.77 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.717 -0.754 . . . . 73.430000000000007 112.489 -179.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 33.8 p-10 -82.35 -16.15 50.23 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.927 0.394 . . . . 54.32 110.922 -179.879 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 80.37 18.73 70.67 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.7 -0.762 . . . . 72.549999999999997 112.53 179.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 22.8 m-85 -143.52 142.56 31.18 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.859 0.361 . . . . 73.420000000000002 110.934 -179.827 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 68.5 mt -103.92 119.46 52.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.173 -0.467 . . . . 74.530000000000001 111.106 179.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 8.5 p -105.05 -175.42 2.79 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.132 -0.485 . . . . 74.209999999999994 110.865 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -74.59 -28.09 60.76 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.104 -0.498 . . . . 43.310000000000002 111.083 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -71.89 -38.34 70.01 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.229 -0.441 . . . . 72.040000000000006 111.13 179.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -74.06 -44.59 53.69 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.196 -0.457 . . . . 74.129999999999995 110.903 -179.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 23.3 tp -52.88 -33.74 51.43 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.162 -0.472 . . . . 75.099999999999994 110.923 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 53.3 ttp85 -70.57 -44.42 67.42 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.164 -0.471 . . . . 74.219999999999999 110.905 179.914 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 2.7 t60 -54.59 -37.24 65.3 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.172 -0.467 . . . . 64.25 110.891 179.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 38.4 t -73.47 -33.18 39.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.191 -0.459 . . . . 72.120000000000005 111.123 179.941 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 15.4 mmt -70.38 -32.46 70.13 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.186 -0.461 . . . . 65.200000000000003 110.902 179.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 20.4 p -60.47 -43.02 97.35 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.226 -0.443 . . . . 74.450000000000003 111.161 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 29.9 m-20 -74.66 -30.18 61.51 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.251 -0.431 . . . . 75.239999999999995 110.901 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 14.9 mt -70.69 -26.04 63.25 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.175 -0.466 . . . . 73.140000000000001 110.927 179.928 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 100.74 30.9 5.94 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.71 -0.757 . . . . 53.240000000000002 112.525 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -125.04 109.97 13.59 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.931 0.396 . . . . 72.200000000000003 110.888 -179.856 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 7.9 ptmm? -75.28 125.97 30.06 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.168 -0.469 . . . . 74.040000000000006 110.889 179.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 36.2 mt -145.12 163.35 34.58 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.201 -0.454 . . . . 72.209999999999994 110.94 179.903 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 23.7 p -118.73 173.7 6.71 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.219 -0.446 . . . . 72.129999999999995 111.101 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -58.01 -38.61 76.48 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.202 -0.454 . . . . 73.310000000000002 110.872 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 13.4 tt0 -71.96 -33.6 68.32 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.207 -0.451 . . . . 71.219999999999999 110.901 -179.92 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -71.1 -44.49 65.54 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.151 -0.477 . . . . 74.209999999999994 110.856 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 39.6 t -58.93 -31.6 45.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.203 -0.453 . . . . 75.120000000000005 111.15 179.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -52.01 -42.3 62.92 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.172 -0.467 . . . . 64.120000000000005 110.863 179.906 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 68.4 tt0 -57.81 -31.4 66.56 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.222 -0.445 . . . . 75.519999999999996 110.908 -179.921 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 30.7 mtp -76.07 -58.76 3.09 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.101 -0.499 . . . . 74.219999999999999 110.897 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 35.9 mm -53.9 -35.71 28.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.215 -0.448 . . . . 73.310000000000002 111.149 179.932 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 38.8 ttt180 -63.42 -31.85 73.13 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.175 -0.466 . . . . 74.109999999999999 110.91 179.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 -74.58 -52.38 11.95 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.198 -0.456 . . . . 72.030000000000001 110.88 -179.94 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -65.34 -34.43 78.3 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.137 -0.483 . . . . 54.299999999999997 111.078 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 49.3 t0 -68.43 86.72 0.3 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.184 -0.462 . . . . 72.239999999999995 110.859 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 59.0 mt -79.82 -46.22 22.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.181 -0.463 . . . . 71.540000000000006 111.135 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 21.2 p30 -72.78 -8.69 56.65 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.202 -0.454 . . . . 73.519999999999996 110.869 179.845 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 62.79 42.71 99.64 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.738 -0.744 . . . . 64.310000000000002 112.46 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 34.7 p-10 -87.75 -15.9 35.71 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.867 0.365 . . . . 74.010000000000005 110.914 179.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 104.1 2.34 45.15 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.719 -0.753 . . . . 72.430000000000007 112.473 -179.941 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 4.2 tt0 -149.21 172.23 15.18 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.808 0.337 . . . . 64.400000000000006 110.921 -179.858 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 136' ' ' VAL . . . . . . . . . . . . . 98.7 t -106.91 109.98 30.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.185 -0.461 . . . . 73.420000000000002 111.132 179.913 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 20.2 p30 -90.99 165.12 13.71 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.159 -0.473 . . . . 73.409999999999997 110.885 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 34.2 t80 -52.16 -46.76 65.6 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.155 -0.475 . . . . 72.420000000000002 110.919 -179.912 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 19.0 tp10 -52.0 -40.15 60.54 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.15 -0.477 . . . . 74.209999999999994 110.835 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 22.9 mt-10 -78.4 -32.68 48.91 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.206 -0.452 . . . . 74.209999999999994 110.916 -179.935 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 65.5 t80 -67.8 -39.01 84.03 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.152 -0.476 . . . . 74.140000000000001 110.89 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 95.7 t -71.25 -50.85 38.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.148 -0.478 . . . . 72.239999999999995 111.142 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 14.9 tt0 -61.32 -38.68 87.77 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.221 -0.445 . . . . 74.109999999999999 110.898 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 15.4 tpt -68.9 -55.58 10.6 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.218 -0.446 . . . . 72.319999999999993 110.862 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 12.5 ttm -60.54 -29.54 69.2 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.234 -0.439 . . . . 73.420000000000002 110.921 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 1.8 m -105.74 21.31 17.47 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.192 -0.458 . . . . 64.450000000000003 111.143 -179.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -51.83 131.16 30.5 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.207 -0.451 . . . . 74.420000000000002 111.1 179.839 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 22.9 pttm . . . . . 0 C--N 1.329 -0.32 0 CA-C-N 116.212 -0.449 . . . . 74.310000000000002 110.842 179.988 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' M' M ' 8' ' ' LEU . . . . . . . . . . . . . 3.1 pp . . . . . 0 C--O 1.231 0.12 0 CA-C-O 120.813 0.34 . . . . 75.120000000000005 110.908 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' M' M ' 9' ' ' SER . . . . . . . . . . . . . 79.6 p -143.59 160.28 40.92 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.205 -0.452 . . . . 70.430000000000007 110.908 -179.906 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' M' M ' 10' ' ' GLY . . . . . . . . . . . . . . . -112.28 -171.64 18.65 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.741 -0.743 . . . . 73.439999999999998 112.474 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' M' M ' 11' ' ' GLY . . . . . . . . . . . . . . . 73.29 29.15 64.7 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.729 -0.748 . . . . 61.020000000000003 112.486 -179.87 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' M' M ' 12' ' ' GLU . . . . . . . . . . . . . 20.0 mt-10 -143.65 -170.81 3.39 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.908 0.385 . . . . 74.420000000000002 110.892 -179.917 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' M' M ' 13' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -87.44 76.65 9.0 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.169 -0.469 . . . . 75.239999999999995 110.91 -179.994 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' M' M ' 14' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -102.43 23.7 11.44 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.21 -0.45 . . . . 74.439999999999998 110.894 179.819 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' M' M ' 15' ' ' LYS . . . . . . . . . . . . . 41.1 mttp -77.0 -49.95 14.26 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.14 -0.482 . . . . 71.140000000000001 110.885 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' M' M ' 16' ' ' TRP . . . . . . . . . . . . . 12.0 m95 -53.01 -40.56 63.93 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.233 -0.439 . . . . 73.340000000000003 110.912 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' M' M ' 17' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -56.35 -26.05 51.32 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.267 -0.424 . . . . 62.039999999999999 110.923 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' M' M ' 18' ' ' LYS . . . . . . . . . . . . . 29.1 tttp -78.69 -26.58 44.95 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.146 -0.479 . . . . 74.239999999999995 110.908 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' M' M ' 19' ' ' ILE . . . . . . . . . . . . . 39.3 mt -87.79 -25.18 6.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.226 -0.443 . . . . 74.549999999999997 111.1 179.88 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' M' M ' 20' ' ' ARG . . . . . . . . . . . . . 25.5 ttp180 -52.11 -37.55 54.49 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.228 -0.442 . . . . 75.420000000000002 110.864 179.962 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' M' M ' 21' ' ' LEU . . . . . . . . . . . . . 7.8 mt 55.31 -175.36 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.19 -0.459 . . . . 74.140000000000001 110.929 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' M' M ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -139.14 149.16 60.12 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.619 0.723 . . . . 74.430000000000007 110.895 179.971 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' M' M ' 23' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.73 101.42 0.9 Allowed 'Trans proline' 0 C--N 1.342 0.201 0 C-N-CA 122.651 2.234 . . . . 71.310000000000002 112.343 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' M' M ' 24' ' ' GLY . . . . . . . . . . . . . . . -145.89 39.56 1.13 Allowed Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.69 -0.766 . . . . 74.430000000000007 112.437 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' M' M ' 25' ' ' GLY . . . . . . . . . . . . . . . -130.78 171.94 20.69 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.746 -0.74 . . . . 44.530000000000001 112.501 -179.924 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' M' M ' 26' ' ' LYS . . . . . . . . . . . . . 4.2 ttpm? -78.04 -73.05 0.33 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.834 0.349 . . . . 73.019999999999996 110.884 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' M' M ' 27' ' ' LYS . . . . . . . . . . . . . 5.4 mptp? 58.84 176.9 0.07 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.206 -0.452 . . . . 71.150000000000006 110.87 179.864 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' M' M ' 28' ' ' GLN . . . . . . . . . . . . . 2.4 pp0? -179.14 173.91 1.1 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.212 -0.449 . . . . 74.140000000000001 110.916 179.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' M' M ' 29' ' ' TYR . . . . . . . . . . . . . 11.7 m-85 -90.69 126.96 36.14 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.218 -0.446 . . . . 74.129999999999995 110.925 -179.897 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' M' M ' 30' ' ' LYS . . . . . . . . . . . . . 15.8 tttp -88.47 8.18 29.23 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.108 -0.496 . . . . 70.209999999999994 110.859 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' M' M ' 31' ' ' LEU . . . . . . . . . . . . . 15.5 tp -106.77 -49.77 3.24 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.233 -0.44 . . . . 74.230000000000004 110.955 179.918 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' M' M ' 32' ' ' LYS . . . . . . . . . . . . . 39.7 tttm -48.23 -45.78 34.59 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.158 -0.473 . . . . 73.519999999999996 110.912 179.789 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' M' M ' 33' ' ' HIS . . . . . . . . . . . . . 19.8 t-160 -51.21 -39.3 56.21 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.257 -0.429 . . . . 73.439999999999998 110.88 179.881 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' M' M ' 34' ' ' ILE . . . . . . . . . . . . . 72.5 mt -51.18 -37.78 18.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.196 -0.456 . . . . 65.439999999999998 111.186 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' M' M ' 35' ' ' VAL . . . . . . . . . . . . . 46.3 t -49.11 -39.11 12.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.157 -0.474 . . . . 72.310000000000002 111.133 179.86 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' M' M ' 36' ' ' TRP . . . . . . . . . . . . . 19.5 m0 -58.44 -40.03 81.47 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.154 -0.475 . . . . 74.25 110.892 179.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' M' M ' 37' ' ' ALA . . . . . . . . . . . . . . . -63.2 -18.7 63.78 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.191 -0.459 . . . . 75.310000000000002 111.097 179.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' M' M ' 38' ' ' SER . . . . . . . . . . . . . 1.5 m -68.24 -18.07 64.46 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.185 -0.462 . . . . 70.450000000000003 110.853 -179.727 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' M' M ' 39' ' ' ARG . . . . . . . . . . . . . 41.2 mtp180 -52.49 -29.56 25.54 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.087 -0.506 . . . . 61.43 110.862 -179.946 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' M' M ' 40' ' ' GLU . . . . . . . . . . . . . 21.7 mt-10 -82.06 -48.05 11.87 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.178 -0.465 . . . . 72.519999999999996 110.892 -179.915 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' M' M ' 41' ' ' LEU . . . . . . . . . . . . . 9.8 mt -62.36 175.63 0.73 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.184 -0.462 . . . . 72.340000000000003 110.929 179.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' M' M ' 42' ' ' GLU . . . . . . . . . . . . . 56.5 mt-10 -150.01 -178.76 6.67 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.214 -0.448 . . . . 72.030000000000001 110.93 179.905 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' M' M ' 43' ' ' ARG . . . . . . . . . . . . . 2.6 tmm_? . . . . . 0 C--N 1.329 -0.285 0 CA-C-N 116.155 -0.475 . . . . 73.329999999999998 110.863 -179.92 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 241' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 262' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 301' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 322' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.103 0 CA-C-O 120.858 0.361 . . . . 64.120000000000005 111.089 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 46.7 m-20 -69.39 143.71 53.6 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.172 -0.467 . . . . 74.349999999999994 110.855 -179.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 12.1 mm100 -95.83 -34.85 11.71 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.211 -0.45 . . . . 73.530000000000001 110.868 -179.867 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 10.6 mt -105.9 146.84 29.45 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.204 -0.453 . . . . 75.409999999999997 110.904 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 4.2 p -120.45 177.08 5.18 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.218 -0.446 . . . . 71.219999999999999 111.146 179.938 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 66.6 tt0 -57.48 -29.87 64.63 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.208 -0.451 . . . . 73.010000000000005 110.852 -179.923 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -68.0 -40.69 82.96 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.181 -0.463 . . . . 73.540000000000006 110.863 -179.931 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 35.0 tt0 -78.02 -36.75 48.31 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.182 -0.463 . . . . 64.230000000000004 110.878 -179.901 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 62.1 mt -72.53 -37.68 57.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.246 -0.434 . . . . 74.510000000000005 111.143 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -56.03 -45.23 79.23 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.115 -0.493 . . . . 62.149999999999999 111.082 179.872 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -66.44 -32.2 73.42 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.2 -0.455 . . . . 74.25 110.921 -179.958 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 9.4 m-85 -73.44 -45.93 51.44 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.119 -0.491 . . . . 74.519999999999996 110.888 -179.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 34.9 ttmt -56.76 -37.61 71.29 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.172 -0.467 . . . . 72.25 110.907 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -59.92 -30.69 69.22 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.272 -0.422 . . . . 75.540000000000006 110.891 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -67.26 -42.39 83.97 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.174 -0.466 . . . . 71.109999999999999 111.119 179.933 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 40.8 t80 -58.16 -54.13 50.39 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.238 -0.437 . . . . 74.420000000000002 110.891 -179.928 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 6.8 t -52.26 -31.09 30.84 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.146 -0.479 . . . . 75.239999999999995 110.833 -179.814 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 16.2 tp -65.74 -49.34 68.78 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.187 -0.461 . . . . 72.120000000000005 110.919 179.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 33.1 m-85 -72.28 -25.97 61.8 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.178 -0.464 . . . . 75.519999999999996 110.853 179.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 13.5 t0 -86.05 98.53 10.9 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.163 -0.472 . . . . 74.209999999999994 110.901 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 6.7 tppt? -68.96 -52.78 25.42 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.23 -0.441 . . . . 71.340000000000003 110.869 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 24.1 p-10 -77.08 -10.08 59.15 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.241 -0.436 . . . . 75.310000000000002 110.913 179.861 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 52.11 48.4 52.77 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.773 -0.727 . . . . 64.099999999999994 112.433 -179.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 31.8 p-10 -88.53 -15.71 34.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.818 0.342 . . . . 74.340000000000003 110.889 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 105.41 -11.64 47.25 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.718 -0.753 . . . . 72.299999999999997 112.5 -179.925 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 4.2 p -132.13 130.7 41.5 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.712 0.292 . . . . 72.310000000000002 111.151 -179.873 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 23.2 mt -89.7 114.01 26.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.239 -0.437 . . . . 71.099999999999994 111.117 179.906 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 44.8 p -93.38 170.67 9.44 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.216 -0.447 . . . . 74.530000000000001 111.113 179.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 82.4 p -58.17 -34.47 70.35 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.213 -0.449 . . . . 72.25 111.119 -179.955 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 30.8 tptt -79.84 -50.13 10.96 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.213 -0.448 . . . . 74.340000000000003 110.922 179.882 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 60.1 mt-10 -59.03 -34.69 72.2 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.189 -0.46 . . . . 74.019999999999996 110.928 179.931 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.1 tt -74.22 -55.68 5.78 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.138 -0.483 . . . . 73.5 110.894 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -52.3 -27.87 25.64 Favored Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.752 -0.737 . . . . 73.340000000000003 112.485 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 96.3 m -58.5 -58.06 10.2 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.838 0.352 . . . . 64.0 111.131 -179.821 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 98.7 t -56.21 -47.55 80.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.225 -0.443 . . . . 73.400000000000006 111.084 179.933 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 7.0 mtp -51.86 -41.36 61.8 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.201 -0.454 . . . . 72.030000000000001 110.879 179.897 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 27.9 ttt180 -53.09 -45.44 68.2 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.244 -0.435 . . . . 74.519999999999996 110.829 -179.896 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.8 p -61.25 -26.14 67.55 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.247 -0.433 . . . . 64.340000000000003 110.843 -179.739 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 18.0 mt -89.86 -16.35 30.27 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.163 -0.472 . . . . 72.450000000000003 110.889 -180.0 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 101.44 27.34 7.26 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.725 -0.75 . . . . 64.420000000000002 112.467 179.853 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 22.0 mm100 -116.88 106.5 13.52 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.78 0.324 . . . . 75.420000000000002 110.901 -179.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 14.6 t-20 -109.99 76.56 1.0 Allowed Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 121.637 0.732 . . . . 74.209999999999994 110.865 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.75 168.09 22.55 Favored 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.656 2.237 . . . . 72.310000000000002 112.334 179.925 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 19.0 p -87.6 156.67 19.39 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.195 -0.457 . . . . 63.130000000000003 111.162 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -51.8 -41.77 61.96 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.205 -0.452 . . . . 61.32 110.893 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.23 -32.16 64.58 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.187 -0.46 . . . . 74.430000000000007 111.098 179.901 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 68.3 tt0 -68.86 -50.08 52.83 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.222 -0.445 . . . . 64.230000000000004 110.915 -179.887 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 16.0 mt -55.12 -45.24 75.54 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.087 -0.506 . . . . 64.239999999999995 110.922 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 3.8 tm0? -71.77 -28.68 63.8 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.166 -0.47 . . . . 73.109999999999999 110.895 179.917 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -63.71 -49.76 71.82 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.231 -0.44 . . . . 74.450000000000003 110.901 179.946 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 5.5 ptp -66.2 -37.47 85.68 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.19 -0.459 . . . . 75.239999999999995 110.872 179.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 66.0 mt -67.07 -38.1 80.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.203 -0.453 . . . . 73.430000000000007 111.059 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 14.3 m-20 -59.58 -37.63 79.05 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.231 -0.44 . . . . 75.299999999999997 110.881 179.935 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 70.0 mm-40 -61.98 -47.95 82.52 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.196 -0.456 . . . . 61.409999999999997 110.897 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 16.9 m -77.81 -15.24 14.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.141 -0.482 . . . . 64.340000000000003 111.099 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 37.3 t0 -66.8 94.26 0.3 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.223 -0.444 . . . . 74.200000000000003 110.861 179.929 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.27 -35.92 16.99 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.182 -0.463 . . . . 72.519999999999996 111.11 179.945 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 1.9 p-10 -88.67 -0.17 57.02 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.235 -0.439 . . . . 72.349999999999994 110.867 179.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 54.5 60.09 9.12 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.746 -0.74 . . . . 61.549999999999997 112.5 -179.913 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 50.9 p-10 -114.6 -15.79 11.94 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.912 0.386 . . . . 72.439999999999998 110.91 -179.921 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 93.4 13.26 56.06 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.771 -0.728 . . . . 53.130000000000003 112.504 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 70.3 p -150.65 171.93 16.36 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.732 0.301 . . . . 75.5 111.157 -179.88 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 16.1 mt -96.1 115.17 34.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.223 -0.444 . . . . 73.430000000000007 111.1 179.947 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.7 t0 -78.78 -175.26 4.35 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.18 -0.464 . . . . 75.329999999999998 110.884 179.866 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.519 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 2.5 t80 -63.5 -58.37 15.75 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.634 0.73 . . . . 72.129999999999995 110.898 -179.888 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . 0.519 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 53.6 Cg_endo -69.79 -30.64 21.82 Favored 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.624 2.216 . . . . 74.239999999999995 112.343 -179.994 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 55.8 mt-10 -59.0 -40.77 85.91 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.268 -0.424 . . . . 71.329999999999998 110.909 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 12.7 t80 -74.17 -35.68 64.02 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.171 -0.468 . . . . 73.409999999999997 110.911 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 27.6 tp -68.4 -53.88 20.86 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.141 -0.482 . . . . 70.299999999999997 110.937 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 15.3 t -53.63 -29.17 36.88 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.184 -0.462 . . . . 74.040000000000006 111.133 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 35.4 ttp -62.78 -43.49 98.66 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.237 -0.438 . . . . 73.310000000000002 110.856 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 3.3 mmt -71.4 -29.72 65.25 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.236 -0.438 . . . . 71.310000000000002 110.9 179.927 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -60.2 -28.73 68.22 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.226 -0.443 . . . . 73.150000000000006 111.136 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -63.01 -24.5 67.95 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.162 -0.472 . . . . 74.349999999999994 110.898 -179.91 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 12.7 ttpt -51.83 -30.18 22.42 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.165 -0.471 . . . . 71.430000000000007 110.93 179.918 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 3.2 tmm? -52.14 -32.93 37.82 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.208 -0.451 . . . . 73.120000000000005 110.855 179.902 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 21.7 ttmm -73.24 -68.58 0.48 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.274 -0.421 . . . . 75.340000000000003 110.912 179.935 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 52.0 t0 52.13 79.19 0.11 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.248 -0.433 . . . . 75.129999999999995 110.868 179.844 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 4.0 m -78.99 69.27 5.12 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.164 -0.471 . . . . 71.329999999999998 111.145 -179.902 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -166.41 -39.52 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.249 -0.432 . . . . 65.329999999999998 110.839 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 3.3 m -61.49 -46.07 91.57 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.222 -0.444 . . . . 73.120000000000005 110.808 -179.678 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -52.34 -29.87 25.83 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.19 -0.459 . . . . 73.219999999999999 110.881 -179.958 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 28.7 tt0 -72.36 -37.42 68.8 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.136 -0.484 . . . . 73.420000000000002 110.903 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -77.76 -43.97 29.1 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.166 -0.47 . . . . 74.430000000000007 110.861 -179.915 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 70.6 mt -56.91 -50.96 73.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.146 -0.479 . . . . 75.439999999999998 111.181 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 45.7 ttp180 -62.5 -28.32 69.75 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.176 -0.465 . . . . 75.239999999999995 110.924 179.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -76.13 -46.87 26.63 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.207 -0.451 . . . . 73.510000000000005 110.922 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -63.75 -42.68 97.8 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.171 -0.468 . . . . 74.25 111.1 179.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 9.9 t80 -52.02 -50.69 60.9 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.211 -0.45 . . . . 74.319999999999993 110.88 -179.905 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 32.1 ttm180 -62.75 -35.98 81.56 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.141 -0.481 . . . . 74.340000000000003 110.858 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 85.3 t -63.91 -42.67 96.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.186 -0.461 . . . . 74.409999999999997 111.134 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 9.2 m-85 -78.2 -31.18 49.31 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.157 -0.474 . . . . 75.439999999999998 110.899 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 22.7 t0 -61.25 96.91 0.06 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.168 -0.469 . . . . 75.450000000000003 110.894 179.98 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 13.4 mmmt -77.35 -53.34 7.8 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.23 -0.441 . . . . 73.140000000000001 110.872 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 16.5 p30 -74.25 -9.19 58.36 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.226 -0.443 . . . . 73.120000000000005 110.838 179.902 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 59.69 25.86 61.78 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.75 -0.738 . . . . 54.100000000000001 112.465 -179.917 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 40.5 p-10 -82.11 -16.16 50.91 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.824 0.345 . . . . 73.450000000000003 110.901 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 86.7 18.7 57.93 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.735 -0.745 . . . . 73.219999999999999 112.485 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 13.0 m-85 -137.85 134.27 34.9 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.888 0.375 . . . . 73.109999999999999 110.933 -179.816 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 71.4 mt -100.04 125.6 53.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.098 -0.501 . . . . 73.430000000000007 111.102 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 86.0 p -109.17 -172.81 2.12 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.198 -0.455 . . . . 72.030000000000001 110.885 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -72.74 -37.11 67.81 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.114 -0.494 . . . . 52.439999999999998 111.074 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -70.24 -49.92 45.1 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.238 -0.437 . . . . 52.240000000000002 111.101 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -62.56 -48.5 79.19 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.227 -0.442 . . . . 75.430000000000007 110.867 -179.911 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 30.4 tp -56.35 -26.85 54.06 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.169 -0.468 . . . . 74.540000000000006 110.904 -179.933 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 17.9 ttm180 -73.35 -29.04 62.39 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.175 -0.466 . . . . 74.329999999999998 110.875 179.938 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 19.8 t60 -66.95 -34.69 78.32 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.191 -0.459 . . . . 73.099999999999994 110.871 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 40.9 t -74.49 -39.58 47.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.17 -0.468 . . . . 72.319999999999993 111.168 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 2.3 mmt -73.87 -38.69 64.34 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.164 -0.471 . . . . 72.349999999999994 110.913 179.857 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 3.0 p -54.12 -32.75 56.0 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.209 -0.45 . . . . 74.430000000000007 111.165 -179.935 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -74.68 -28.35 60.79 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.218 -0.446 . . . . 74.019999999999996 110.887 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -70.68 -25.95 63.21 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.19 -0.459 . . . . 74.129999999999995 110.933 179.947 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 100.84 19.4 17.51 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.73 -0.748 . . . . 62.530000000000001 112.518 179.93 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -102.81 127.9 49.79 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.873 0.368 . . . . 73.400000000000006 110.896 -179.874 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 34.0 mttp -80.83 117.51 21.55 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.186 -0.461 . . . . 73.319999999999993 110.929 179.945 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 15.3 mt -130.02 113.34 14.44 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.253 -0.43 . . . . 75.030000000000001 110.909 179.933 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 75.1 p -81.91 171.22 14.71 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.17 -0.468 . . . . 73.120000000000005 111.156 179.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 46.7 m-20 -52.01 -36.68 50.78 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.238 -0.437 . . . . 74.040000000000006 110.826 179.9 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -75.23 -33.4 61.35 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.163 -0.471 . . . . 73.109999999999999 110.928 -179.91 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -69.63 -42.19 74.62 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.111 -0.495 . . . . 64.140000000000001 110.906 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 21.8 t -61.03 -38.62 79.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.163 -0.471 . . . . 74.540000000000006 111.119 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 50.0 t0 -56.88 -45.48 82.49 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.212 -0.449 . . . . 72.439999999999998 110.9 179.901 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 15.5 tm-20 -57.51 -34.26 68.91 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.193 -0.458 . . . . 73.319999999999993 110.839 -179.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 27.1 mtp -70.69 -59.56 2.75 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.2 -0.454 . . . . 71.510000000000005 110.862 -179.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 36.3 mm -53.97 -35.5 28.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.211 -0.449 . . . . 74.310000000000002 111.134 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 56.5 ttt85 -63.07 -31.84 73.08 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.171 -0.468 . . . . 75.549999999999997 110.863 179.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -75.11 -52.38 11.14 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.148 -0.478 . . . . 64.019999999999996 110.9 -179.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -64.88 -34.41 78.32 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.168 -0.469 . . . . 73.25 111.126 179.909 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 49.0 t0 -68.37 86.9 0.29 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.197 -0.456 . . . . 74.099999999999994 110.853 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 64.7 mt -79.85 -46.61 22.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.178 -0.465 . . . . 74.120000000000005 111.145 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 21.5 p30 -72.63 -8.69 56.53 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.175 -0.466 . . . . 74.519999999999996 110.865 179.848 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 62.86 43.02 99.54 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.73 -0.748 . . . . 72.340000000000003 112.497 -179.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 34.5 p-10 -88.51 -15.91 34.05 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.865 0.364 . . . . 64.329999999999998 110.869 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 104.14 2.35 45.03 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.768 -0.729 . . . . 64.150000000000006 112.468 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 5.3 tt0 -149.21 172.29 15.08 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.814 0.34 . . . . 74.239999999999995 110.913 -179.902 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 136' ' ' VAL . . . . . . . . . . . . . 72.4 t -106.83 109.28 27.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.185 -0.462 . . . . 75.239999999999995 111.111 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 20.9 p30 -91.27 164.79 13.75 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.159 -0.473 . . . . 50.240000000000002 110.859 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 37.5 t80 -52.25 -46.22 65.68 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.185 -0.462 . . . . 65.409999999999997 110.923 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -51.91 -39.74 59.58 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.117 -0.492 . . . . 72.239999999999995 110.868 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 26.1 mt-10 -78.38 -37.36 44.32 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.172 -0.467 . . . . 52.530000000000001 110.887 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 36.8 t80 -63.95 -39.61 94.55 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.135 -0.484 . . . . 74.430000000000007 110.855 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 90.9 t -63.74 -50.72 76.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.175 -0.466 . . . . 74.019999999999996 111.119 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 43.3 tt0 -70.8 -23.38 62.36 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.181 -0.463 . . . . 73.230000000000004 110.927 -179.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 11.7 tpt -75.03 -18.73 60.29 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.157 -0.474 . . . . 74.439999999999998 110.904 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 5.8 ttm -98.2 -32.98 11.3 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.225 -0.443 . . . . 72.019999999999996 110.856 179.954 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 5.0 t -73.38 -24.02 60.26 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.256 -0.429 . . . . 51.229999999999997 111.128 -179.918 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -100.27 -75.43 0.58 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.239 -0.437 . . . . 71.409999999999997 111.1 179.854 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.348 0 CA-C-N 116.246 -0.434 . . . . 72.349999999999994 110.881 179.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' M' M ' 8' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.231 0.131 0 CA-C-O 120.852 0.358 . . . . 74.310000000000002 110.913 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' M' M ' 9' ' ' SER . . . . . . . . . . . . . 2.8 t -156.5 157.67 35.86 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.202 -0.453 . . . . 74.420000000000002 110.879 -179.937 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' M' M ' 10' ' ' GLY . . . . . . . . . . . . . . . -69.4 -28.69 72.24 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.744 -0.741 . . . . 75.239999999999995 112.514 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' M' M ' 11' ' ' GLY . . . . . . . . . . . . . . . -90.61 -159.92 36.06 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.719 -0.753 . . . . 53.329999999999998 112.475 -179.923 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' M' M ' 12' ' ' GLU . . . . . . . . . . . . . 47.0 tp10 53.98 89.06 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.878 0.371 . . . . 74.420000000000002 110.862 -179.848 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' M' M ' 13' ' ' LEU . . . . . . . . . . . . . 1.6 tt -88.5 121.26 30.69 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.16 -0.473 . . . . 73.200000000000003 110.919 179.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' M' M ' 14' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -98.06 61.31 1.5 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.178 -0.464 . . . . 73.120000000000005 110.873 179.844 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' M' M ' 15' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -79.18 -22.92 44.28 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.182 -0.463 . . . . 74.219999999999999 110.939 179.988 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' M' M ' 16' ' ' TRP . . . . . . . . . . . . . 3.1 m95 -51.94 -38.59 57.04 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.222 -0.445 . . . . 72.540000000000006 110.865 179.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' M' M ' 17' ' ' GLU . . . . . . . . . . . . . 58.4 tt0 -56.07 -30.91 62.68 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.251 -0.431 . . . . 74.140000000000001 110.944 -179.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' M' M ' 18' ' ' LYS . . . . . . . . . . . . . 6.5 tppt? -52.02 -30.41 25.28 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.13 -0.486 . . . . 73.439999999999998 110.892 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' M' M ' 19' ' ' ILE . . . . . . . . . . . . . 64.1 mt -91.31 -24.54 5.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.167 -0.47 . . . . 74.200000000000003 111.088 179.901 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' M' M ' 20' ' ' ARG . . . . . . . . . . . . . 12.1 ttm180 -66.87 -25.83 66.6 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.204 -0.453 . . . . 73.319999999999993 110.835 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' M' M ' 21' ' ' LEU . . . . . . . . . . . . . 46.9 mt 60.75 -173.86 0.12 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.213 -0.449 . . . . 74.430000000000007 110.919 -179.931 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' M' M ' 22' ' ' ARG . . . . . . . . . . . . . 8.6 mpt_? -104.8 144.23 28.3 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-O 121.579 0.704 . . . . 75.25 110.865 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' M' M ' 23' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.76 -176.81 1.61 Allowed 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.663 2.242 . . . . 72.140000000000001 112.354 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' M' M ' 24' ' ' GLY . . . . . . . . . . . . . . . 140.72 127.67 2.36 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.773 -0.727 . . . . 71.310000000000002 112.515 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' M' M ' 25' ' ' GLY . . . . . . . . . . . . . . . 164.82 -167.12 38.42 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.723 -0.751 . . . . 54.520000000000003 112.515 -179.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' M' M ' 26' ' ' LYS . . . . . . . . . . . . . 12.8 ptmt -63.13 -27.28 69.27 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.834 0.349 . . . . 71.400000000000006 110.898 179.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' M' M ' 27' ' ' LYS . . . . . . . . . . . . . 10.8 mttm 62.8 -172.87 0.16 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.243 -0.435 . . . . 74.430000000000007 110.874 179.844 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' M' M ' 28' ' ' GLN . . . . . . . . . . . . . 22.7 mm100 -75.93 -74.19 0.23 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.209 -0.45 . . . . 53.450000000000003 110.897 179.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' M' M ' 29' ' ' TYR . . . . . . . . . . . . . 13.7 m-85 -92.75 179.89 5.35 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.187 -0.461 . . . . 74.430000000000007 110.927 -179.841 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' M' M ' 30' ' ' LYS . . . . . . . . . . . . . 14.5 mtmm -101.89 -21.21 14.59 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.173 -0.467 . . . . 73.310000000000002 110.889 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' M' M ' 31' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -96.99 -28.05 14.34 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.247 -0.433 . . . . 74.150000000000006 110.909 179.927 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' M' M ' 32' ' ' LYS . . . . . . . . . . . . . 7.5 tttp -49.2 -46.42 45.67 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.205 -0.452 . . . . 75.340000000000003 110.889 179.825 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' M' M ' 33' ' ' HIS . . . . . . . . . . . . . 22.1 t-160 -50.95 -37.18 42.87 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.239 -0.437 . . . . 72.239999999999995 110.842 179.91 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' M' M ' 34' ' ' ILE . . . . . . . . . . . . . 47.6 mm -50.33 -39.57 17.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.221 -0.445 . . . . 75.0 111.157 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' M' M ' 35' ' ' VAL . . . . . . . . . . . . . 46.9 t -48.86 -40.18 12.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.131 -0.486 . . . . 72.209999999999994 111.132 179.818 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' M' M ' 36' ' ' TRP . . . . . . . . . . . . . 23.6 m0 -58.62 -39.91 81.82 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.177 -0.465 . . . . 75.450000000000003 110.956 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' M' M ' 37' ' ' ALA . . . . . . . . . . . . . . . -63.69 -18.66 64.21 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.198 -0.455 . . . . 73.230000000000004 111.141 179.845 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' M' M ' 38' ' ' SER . . . . . . . . . . . . . 13.2 m -69.48 -17.95 63.66 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.199 -0.455 . . . . 72.409999999999997 110.876 -179.811 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' M' M ' 39' ' ' ARG . . . . . . . . . . . . . 25.8 mmm180 -63.11 -24.18 67.78 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.122 -0.49 . . . . 75.25 110.831 -179.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' M' M ' 40' ' ' GLU . . . . . . . . . . . . . 17.3 tt0 -80.72 -48.07 13.07 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.212 -0.449 . . . . 74.010000000000005 110.905 -179.946 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' M' M ' 41' ' ' LEU . . . . . . . . . . . . . 19.7 mt -52.36 170.3 0.07 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.168 -0.469 . . . . 74.299999999999997 110.913 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' M' M ' 42' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -67.39 129.87 41.28 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.177 -0.465 . . . . 74.230000000000004 110.843 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' M' M ' 43' ' ' ARG . . . . . . . . . . . . . 18.3 ttt180 . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 116.123 -0.489 . . . . 64.310000000000002 110.844 -179.923 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 241' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 262' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 301' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 322' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.112 0 CA-C-O 120.764 0.316 . . . . 75.25 111.106 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -108.31 -66.78 1.01 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.22 -0.446 . . . . 74.439999999999998 110.899 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 47.3 mt-30 -84.7 176.83 8.31 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.206 -0.452 . . . . 73.349999999999994 110.925 -179.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 10.8 mt -126.33 151.63 47.31 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.171 -0.468 . . . . 75.420000000000002 110.884 -179.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 61.6 p -115.86 176.39 5.11 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.165 -0.47 . . . . 73.519999999999996 111.201 179.912 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 21.2 tt0 -55.76 -29.22 59.26 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.238 -0.437 . . . . 75.120000000000005 110.941 179.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -67.17 -37.58 83.96 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.11 -0.495 . . . . 62.030000000000001 110.876 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 28.5 tp60 -77.84 -42.47 33.52 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.125 -0.489 . . . . 74.200000000000003 110.915 -179.913 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 54.3 mt -69.16 -37.25 76.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.205 -0.452 . . . . 74.400000000000006 111.114 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -51.95 -39.06 58.65 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.161 -0.472 . . . . 73.340000000000003 111.12 179.796 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 56.8 mt-10 -72.64 -52.03 17.06 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.234 -0.439 . . . . 73.420000000000002 110.89 -179.917 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 30.4 m-85 -55.96 -39.6 71.99 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.151 -0.477 . . . . 74.319999999999993 110.861 -179.913 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.14 -31.35 65.25 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.109 -0.496 . . . . 73.299999999999997 110.883 -179.985 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 24.4 tt0 -72.27 -30.71 65.11 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.231 -0.44 . . . . 63.32 110.879 179.966 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -72.77 -35.04 67.35 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.162 -0.472 . . . . 65.230000000000004 111.115 179.92 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 91.5 t80 -75.63 -51.99 11.58 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.213 -0.449 . . . . 73.319999999999993 110.87 -179.874 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 14.8 t -52.03 -31.79 31.42 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.158 -0.474 . . . . 75.450000000000003 110.845 -179.79 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 15.9 tp -64.05 -47.11 81.46 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.071 -0.513 . . . . 73.010000000000005 110.911 -179.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 17.2 m-85 -69.79 -24.82 63.55 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.183 -0.462 . . . . 73.400000000000006 110.848 179.972 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 21.2 t0 -86.59 98.58 11.17 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.184 -0.462 . . . . 71.040000000000006 110.812 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 5.0 mptp? -71.23 -55.51 7.95 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.166 -0.47 . . . . 72.0 110.85 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 23.1 p-10 -71.12 -10.25 59.43 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.249 -0.432 . . . . 71.510000000000005 110.833 179.892 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 51.49 40.6 47.21 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.746 -0.74 . . . . 61.539999999999999 112.522 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 21.1 p-10 -88.31 -15.7 35.04 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.878 0.37 . . . . 74.319999999999993 110.909 -179.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 104.64 -11.69 50.17 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.72 -0.752 . . . . 73.230000000000004 112.518 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 5.0 p -129.05 130.67 46.86 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.739 0.305 . . . . 71.519999999999996 111.182 -179.896 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 24.8 mt -96.83 128.64 47.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.244 -0.434 . . . . 74.510000000000005 111.149 179.933 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 32.2 p -108.31 -177.5 3.34 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.159 -0.473 . . . . 74.129999999999995 111.187 179.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 39.2 p -64.6 -37.32 87.15 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.259 -0.428 . . . . 73.349999999999994 111.141 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 6.0 mmmm -71.99 -49.92 33.12 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.176 -0.466 . . . . 72.150000000000006 110.894 179.891 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 68.8 mt-10 -60.47 -36.61 78.67 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.212 -0.449 . . . . 75.439999999999998 110.879 179.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.2 tt -74.28 -55.63 5.81 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.131 -0.486 . . . . 75.340000000000003 110.931 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -52.08 -28.03 24.4 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.76 -0.734 . . . . 53.5 112.479 179.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 95.8 m -65.76 -54.51 26.14 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.767 0.318 . . . . 71.310000000000002 111.146 -179.889 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 42.7 t -55.98 -50.22 70.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.275 -0.421 . . . . 71.549999999999997 111.107 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -51.99 -38.06 55.37 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.177 -0.465 . . . . 64.120000000000005 110.853 179.915 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 32.7 ttm-85 -53.5 -52.89 58.12 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.277 -0.42 . . . . 74.439999999999998 110.872 -179.903 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 3.1 t -64.76 -26.56 68.41 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.199 -0.455 . . . . 64.239999999999995 110.864 -179.826 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 61.9 mt -79.45 -18.6 51.78 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.152 -0.477 . . . . 72.030000000000001 110.958 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 101.45 28.24 6.83 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.746 -0.74 . . . . 72.239999999999995 112.458 179.88 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 48.4 mm-40 -125.09 129.88 51.12 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.819 0.342 . . . . 62.439999999999998 110.908 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 39.2 t30 -109.86 80.02 1.61 Allowed Pre-proline 0 C--N 1.33 -0.28 0 CA-C-O 121.602 0.715 . . . . 72.319999999999993 110.896 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.7 147.94 64.37 Favored 'Trans proline' 0 C--O 1.231 0.174 0 C-N-CA 122.724 2.283 . . . . 75.0 112.346 179.913 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 21.3 p -96.01 162.56 13.5 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.209 -0.45 . . . . 72.540000000000006 111.189 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 20.7 tt0 -55.28 -44.39 75.61 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.26 -0.427 . . . . 74.430000000000007 110.846 -179.951 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.25 -31.73 64.28 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.186 -0.461 . . . . 75.549999999999997 111.094 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 78.4 tt0 -66.46 -49.29 67.16 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.246 -0.434 . . . . 75.319999999999993 110.92 -179.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 14.8 mt -55.15 -51.68 65.7 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.158 -0.474 . . . . 75.439999999999998 110.95 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 15.9 tp60 -55.01 -28.93 55.84 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.196 -0.456 . . . . 65.439999999999998 110.933 179.92 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -72.89 -40.05 65.9 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.182 -0.463 . . . . 73.409999999999997 110.825 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 38.2 mtp -76.36 -25.26 54.46 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.206 -0.452 . . . . 73.030000000000001 110.868 -179.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 80.3 mt -79.67 -40.64 21.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.259 -0.428 . . . . 74.230000000000004 111.14 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 49.2 m-20 -60.16 -48.8 80.21 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.178 -0.464 . . . . 74.319999999999993 110.905 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 18.0 pt-20 -55.7 -27.07 48.36 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.121 -0.49 . . . . 72.299999999999997 110.911 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 32.4 m -108.34 11.71 8.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.151 -0.477 . . . . 74.140000000000001 111.166 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 26.9 t0 -90.03 98.13 11.59 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.149 -0.478 . . . . 61.119999999999997 110.863 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.28 -46.25 9.37 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.206 -0.452 . . . . 63.329999999999998 111.13 179.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 10.2 p-10 -81.66 -0.19 41.49 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.196 -0.456 . . . . 75.019999999999996 110.863 179.96 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 53.65 56.5 19.93 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.718 -0.753 . . . . 61.100000000000001 112.508 -179.928 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 49.6 p-10 -114.51 -15.82 11.98 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.845 0.355 . . . . 73.430000000000007 110.861 -179.857 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 91.93 17.41 47.9 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.755 -0.736 . . . . 72.340000000000003 112.477 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 20.4 p -145.54 168.37 20.76 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.793 0.33 . . . . 73.430000000000007 111.11 -179.876 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 16.9 mt -106.72 109.49 28.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.163 -0.471 . . . . 73.319999999999993 111.133 179.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -76.9 -172.97 2.5 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.167 -0.469 . . . . 72.329999999999998 110.852 179.864 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.522 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 2.5 t80 -65.58 -58.43 11.77 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-O 121.667 0.746 . . . . 73.150000000000006 110.92 -179.936 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . 0.522 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 54.2 Cg_endo -69.75 -24.98 29.11 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.658 2.239 . . . . 75.349999999999994 112.365 179.949 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 22.7 mt-10 -63.66 -40.67 97.41 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.237 -0.438 . . . . 75.230000000000004 110.914 -179.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 34.3 t80 -74.02 -36.28 64.45 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.161 -0.472 . . . . 64.310000000000002 110.883 -179.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 50.1 tp -70.64 -53.9 14.03 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.171 -0.468 . . . . 75.349999999999994 110.949 179.981 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 13.1 t -55.64 -26.55 45.01 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.178 -0.465 . . . . 73.549999999999997 111.126 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 9.1 tmm? -62.83 -39.61 94.84 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.197 -0.456 . . . . 74.25 110.892 179.913 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -79.76 -40.02 29.7 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.22 -0.445 . . . . 74.430000000000007 110.938 179.918 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -66.75 -34.86 78.77 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.184 -0.462 . . . . 74.239999999999995 111.085 179.9 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 15.2 ttp180 -58.41 -24.64 60.65 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.217 -0.447 . . . . 65.150000000000006 110.856 -179.847 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 39.7 tttm -74.8 -6.5 49.34 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.218 -0.446 . . . . 74.319999999999993 110.927 179.924 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 18.5 ptm -51.3 -30.83 19.4 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.179 -0.464 . . . . 75.519999999999996 110.916 179.848 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 3.3 tppp? -174.7 -74.82 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.192 -0.458 . . . . 72.409999999999997 110.838 179.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 36.5 t70 -71.7 113.6 8.91 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.245 -0.434 . . . . 71.040000000000006 110.889 179.87 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 10.4 t -166.41 28.15 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.199 -0.455 . . . . 74.530000000000001 111.12 -179.893 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -125.56 8.02 7.64 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.235 -0.439 . . . . 73.519999999999996 110.866 179.952 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 33.7 p -77.86 -52.58 8.66 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.167 -0.47 . . . . 74.239999999999995 110.86 -179.74 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 11.8 mm-40 -72.18 -42.08 66.26 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.122 -0.49 . . . . 75.329999999999998 110.868 -179.948 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -53.47 -28.41 30.43 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.177 -0.465 . . . . 73.430000000000007 110.89 -179.928 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 2.9 tm-20 -69.88 -50.94 37.49 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.127 -0.488 . . . . 74.140000000000001 110.914 -179.906 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 3.1 mp -70.43 -50.97 41.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.13 -0.486 . . . . 71.219999999999999 111.148 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 41.8 ttm-85 -54.69 -28.15 45.58 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.151 -0.477 . . . . 74.409999999999997 110.885 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 7.9 tm-20 -74.94 -58.52 3.23 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.177 -0.465 . . . . 71.400000000000006 110.866 -179.948 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -58.83 -43.31 90.63 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.177 -0.465 . . . . 74.549999999999997 111.129 179.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 4.1 t80 -52.01 -48.11 64.63 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.166 -0.47 . . . . 64.540000000000006 110.925 -179.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.22 -26.19 64.68 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.13 -0.486 . . . . 75.409999999999997 110.905 -179.95 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 93.0 t -77.36 -27.31 15.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.16 -0.473 . . . . 74.540000000000006 111.133 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 18.2 m-85 -94.77 -28.48 15.25 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.174 -0.466 . . . . 75.540000000000006 110.872 -179.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 34.6 t0 -66.9 95.86 0.39 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.12 -0.491 . . . . 74.519999999999996 110.888 179.981 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 71.1 mmtt -78.73 -52.26 8.63 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.201 -0.454 . . . . 72.120000000000005 110.899 179.997 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 10.2 p30 -72.32 -9.2 58.18 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.193 -0.458 . . . . 74.299999999999997 110.838 179.886 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 59.19 26.22 61.07 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.733 -0.746 . . . . 72.200000000000003 112.518 -179.923 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 35.7 p-10 -81.75 -16.16 51.99 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.91 0.386 . . . . 74.340000000000003 110.895 -179.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 87.05 18.71 57.34 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.742 -0.742 . . . . 70.400000000000006 112.506 -179.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 19.7 m-85 -141.96 146.55 35.76 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.834 0.349 . . . . 74.209999999999994 110.948 -179.791 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 62.1 mt -112.89 127.47 70.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.108 -0.496 . . . . 74.219999999999999 111.178 179.87 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 96.3 p -112.75 -172.59 2.08 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.163 -0.471 . . . . 74.530000000000001 110.835 -179.876 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -65.4 -34.14 77.61 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.129 -0.487 . . . . 73.329999999999998 111.095 179.914 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -70.4 -49.89 44.27 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.213 -0.449 . . . . 72.040000000000006 111.064 179.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 21.5 mt-10 -62.24 -50.21 72.67 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.243 -0.435 . . . . 73.120000000000005 110.853 -179.875 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 12.0 tp -53.6 -52.46 59.73 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.151 -0.477 . . . . 75.200000000000003 110.946 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 31.9 ttp180 -57.34 -42.29 81.69 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.158 -0.474 . . . . 73.219999999999999 110.855 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 50.3 t60 -60.34 -34.42 73.81 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.249 -0.432 . . . . 62.32 110.903 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 95.8 t -71.53 -52.47 25.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.188 -0.46 . . . . 74.310000000000002 111.087 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 5.6 tpp -62.69 -42.03 99.42 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.174 -0.467 . . . . 74.430000000000007 110.882 179.929 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 12.8 p -53.84 -36.62 62.77 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.255 -0.429 . . . . 73.310000000000002 111.138 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 87.9 m-20 -61.13 -30.24 70.25 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.248 -0.433 . . . . 73.310000000000002 110.893 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 23.5 mt -70.75 -23.38 62.42 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.168 -0.469 . . . . 72.439999999999998 110.914 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 101.02 32.98 5.12 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.77 -0.729 . . . . 63.310000000000002 112.509 179.901 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 34.9 tp10 -111.65 111.02 21.72 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.934 0.397 . . . . 71.409999999999997 110.922 -179.905 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 5.8 ptpp? -60.67 127.79 33.41 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.116 -0.493 . . . . 71.420000000000002 110.845 -179.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 30.5 mt -146.75 162.5 38.42 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.235 -0.438 . . . . 74.299999999999997 110.928 179.895 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 33.1 p -118.68 159.87 22.87 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.167 -0.47 . . . . 74.540000000000006 111.177 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -52.24 -39.58 60.49 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.217 -0.447 . . . . 71.340000000000003 110.857 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -72.48 -33.37 66.94 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.187 -0.46 . . . . 74.510000000000005 110.877 -179.893 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 65.4 tt0 -66.34 -39.21 89.05 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.15 -0.477 . . . . 75.219999999999999 110.888 -179.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 89.4 t -62.62 -34.24 64.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.158 -0.474 . . . . 73.310000000000002 111.133 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -51.97 -45.34 64.4 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.205 -0.452 . . . . 70.040000000000006 110.854 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 17.9 tp10 -56.62 -29.34 62.08 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.21 -0.45 . . . . 74.25 110.893 -179.915 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 8.7 mtp -74.46 -56.98 4.24 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.178 -0.464 . . . . 75.400000000000006 110.923 179.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 34.7 mm -54.05 -35.57 29.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.23 -0.441 . . . . 75.109999999999999 111.097 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 16.3 tpt180 -65.85 -31.75 72.88 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.203 -0.453 . . . . 73.400000000000006 110.869 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -71.33 -48.82 48.0 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.196 -0.456 . . . . 74.040000000000006 110.903 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -71.75 -34.2 69.31 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.165 -0.47 . . . . 63.25 111.089 179.97 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 49.8 t0 -68.27 86.79 0.28 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.228 -0.442 . . . . 75.439999999999998 110.887 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 56.5 mt -79.94 -46.0 22.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.204 -0.453 . . . . 73.430000000000007 111.124 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 21.7 p30 -72.7 -8.73 56.8 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.17 -0.468 . . . . 63.509999999999998 110.906 179.822 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 62.84 43.38 99.02 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.725 -0.75 . . . . 63.509999999999998 112.499 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 34.5 p-10 -88.69 -16.01 33.41 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.818 0.342 . . . . 75.340000000000003 110.841 -179.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 103.87 2.45 45.96 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.759 -0.734 . . . . 72.209999999999994 112.476 -179.928 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 4.5 tt0 -149.2 172.26 15.13 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.82 0.343 . . . . 74.209999999999994 110.941 -179.913 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 136' ' ' VAL . . . . . . . . . . . . . 94.4 t -108.21 111.82 37.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.204 -0.453 . . . . 75.129999999999995 111.082 179.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 15.5 p30 -91.85 179.63 5.56 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.155 -0.475 . . . . 74.109999999999999 110.917 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 36.1 t80 -63.97 -47.65 79.57 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.194 -0.457 . . . . 75.120000000000005 110.927 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 14.3 tt0 -52.04 -39.86 60.21 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.139 -0.482 . . . . 62.240000000000002 110.867 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -78.49 -42.46 29.62 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.221 -0.445 . . . . 64.209999999999994 110.898 -179.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 24.4 t80 -58.93 -36.7 75.2 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.15 -0.477 . . . . 74.409999999999997 110.859 -179.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 94.0 t -66.66 -44.85 89.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.184 -0.462 . . . . 75.310000000000002 111.119 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 31.1 tt0 -66.54 -42.94 86.41 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.207 -0.451 . . . . 75.319999999999993 110.91 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 33.6 tpp -65.11 -26.75 68.34 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.216 -0.447 . . . . 74.129999999999995 110.868 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -84.37 -28.16 27.17 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.232 -0.44 . . . . 72.310000000000002 110.832 179.973 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 1.6 m -104.63 21.31 17.05 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.275 -0.42 . . . . 72.109999999999999 111.092 -179.886 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -67.79 102.11 1.18 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.229 -0.441 . . . . 73.209999999999994 111.088 179.896 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 18.6 mtpp . . . . . 0 C--N 1.328 -0.329 0 CA-C-N 116.239 -0.437 . . . . 75.319999999999993 110.947 179.94 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' M' M ' 8' ' ' LEU . . . . . . . . . . . . . 4.6 mm? . . . . . 0 C--O 1.231 0.08 0 CA-C-O 120.843 0.354 . . . . 75.409999999999997 110.896 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' M' M ' 9' ' ' SER . . . . . . . . . . . . . 8.3 t -145.66 -42.43 0.22 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.143 -0.48 . . . . 73.209999999999994 110.868 -179.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' M' M ' 10' ' ' GLY . . . . . . . . . . . . . . . -132.91 142.19 13.67 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.741 -0.742 . . . . 64.519999999999996 112.494 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' M' M ' 11' ' ' GLY . . . . . . . . . . . . . . . 168.1 -43.67 0.23 Allowed Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.731 -0.747 . . . . 63.240000000000002 112.447 -179.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' M' M ' 12' ' ' GLU . . . . . . . . . . . . . 15.8 mt-10 -66.27 115.74 6.57 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.926 0.393 . . . . 74.049999999999997 110.888 -179.872 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' M' M ' 13' ' ' LEU . . . . . . . . . . . . . 2.7 tt -88.18 145.02 26.12 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.137 -0.483 . . . . 74.129999999999995 110.919 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' M' M ' 14' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -51.3 -62.77 1.42 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.197 -0.456 . . . . 75.140000000000001 110.872 179.864 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' M' M ' 15' ' ' LYS . . . . . . . . . . . . . 11.3 mttm -50.61 -49.72 55.89 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.207 -0.451 . . . . 75.519999999999996 110.871 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' M' M ' 16' ' ' TRP . . . . . . . . . . . . . 5.6 m95 -52.27 -42.97 64.15 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.231 -0.441 . . . . 75.319999999999993 110.909 179.921 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' M' M ' 17' ' ' GLU . . . . . . . . . . . . . 48.3 tt0 -58.37 -28.08 64.8 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.224 -0.443 . . . . 74.310000000000002 110.902 -179.942 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' M' M ' 18' ' ' LYS . . . . . . . . . . . . . 14.2 ttmm -68.36 -25.85 65.29 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.146 -0.479 . . . . 73.230000000000004 110.892 179.948 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' M' M ' 19' ' ' ILE . . . . . . . . . . . . . 33.5 mt -86.46 -13.2 10.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.23 -0.441 . . . . 73.530000000000001 111.131 179.865 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' M' M ' 20' ' ' ARG . . . . . . . . . . . . . 39.7 ttp180 -66.28 -39.66 89.56 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.178 -0.465 . . . . 71.040000000000006 110.897 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' M' M ' 21' ' ' LEU . . . . . . . . . . . . . 16.0 mt 53.63 -169.94 0.05 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.209 -0.451 . . . . 75.319999999999993 110.91 -180.0 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' M' M ' 22' ' ' ARG . . . . . . . . . . . . . 24.6 mtp85 -156.5 57.57 1.46 Allowed Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 121.629 0.728 . . . . 75.019999999999996 110.836 179.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' M' M ' 23' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.79 -171.1 0.44 Allowed 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.716 2.278 . . . . 73.019999999999996 112.376 179.961 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' M' M ' 24' ' ' GLY . . . . . . . . . . . . . . . -144.1 -109.96 0.7 Allowed Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.744 -0.741 . . . . 60.439999999999998 112.479 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' M' M ' 25' ' ' GLY . . . . . . . . . . . . . . . 81.22 -84.77 1.43 Allowed Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.726 -0.749 . . . . 73.400000000000006 112.457 -179.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' M' M ' 26' ' ' LYS . . . . . . . . . . . . . 13.8 ttpt 63.57 160.0 0.09 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.827 0.346 . . . . 74.109999999999999 110.921 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' M' M ' 27' ' ' LYS . . . . . . . . . . . . . 30.6 mmtp 58.46 -169.62 0.12 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.257 -0.429 . . . . 73.030000000000001 110.922 179.889 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' M' M ' 28' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER 63.69 106.17 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.244 -0.435 . . . . 71.109999999999999 110.936 179.954 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' M' M ' 29' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -113.52 -22.3 10.39 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.236 -0.438 . . . . 74.420000000000002 110.908 -179.865 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' M' M ' 30' ' ' LYS . . . . . . . . . . . . . 17.4 tttm 63.67 29.19 15.06 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.121 -0.491 . . . . 73.540000000000006 110.862 179.893 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' M' M ' 31' ' ' LEU . . . . . . . . . . . . . 10.1 tp -144.94 -52.16 0.28 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.256 -0.429 . . . . 75.230000000000004 110.934 179.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' M' M ' 32' ' ' LYS . . . . . . . . . . . . . 3.2 ptmm? -49.53 -36.18 22.63 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.188 -0.46 . . . . 75.519999999999996 110.9 179.824 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' M' M ' 33' ' ' HIS . . . . . . . . . . . . . 12.7 t-160 -49.74 -42.61 46.66 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.201 -0.454 . . . . 73.400000000000006 110.861 179.898 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' M' M ' 34' ' ' ILE . . . . . . . . . . . . . 55.1 mt -50.69 -38.69 17.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.201 -0.454 . . . . 74.5 111.145 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' M' M ' 35' ' ' VAL . . . . . . . . . . . . . 39.9 t -49.6 -39.54 14.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.139 -0.482 . . . . 75.120000000000005 111.166 179.859 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' M' M ' 36' ' ' TRP . . . . . . . . . . . . . 21.9 m0 -58.94 -39.29 81.18 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.196 -0.456 . . . . 72.099999999999994 110.926 179.966 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' M' M ' 37' ' ' ALA . . . . . . . . . . . . . . . -63.82 -18.64 64.33 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.226 -0.443 . . . . 72.439999999999998 111.091 179.88 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' M' M ' 38' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -71.88 -17.96 62.08 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.193 -0.458 . . . . 75.420000000000002 110.843 -179.787 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' M' M ' 39' ' ' ARG . . . . . . . . . . . . . 60.1 mtt180 -56.48 -25.83 52.32 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.201 -0.454 . . . . 74.109999999999999 110.894 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' M' M ' 40' ' ' GLU . . . . . . . . . . . . . 22.7 tt0 -87.43 -47.99 8.33 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.205 -0.452 . . . . 75.200000000000003 110.905 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' M' M ' 41' ' ' LEU . . . . . . . . . . . . . 11.7 mt -64.49 153.66 38.24 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.179 -0.464 . . . . 73.019999999999996 110.957 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' M' M ' 42' ' ' GLU . . . . . . . . . . . . . 15.1 tp10 -103.85 -57.83 1.97 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.193 -0.458 . . . . 75.430000000000007 110.916 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' M' M ' 43' ' ' ARG . . . . . . . . . . . . . 47.7 ttt-85 . . . . . 0 C--N 1.329 -0.289 0 CA-C-N 116.133 -0.485 . . . . 73.209999999999994 110.892 -179.955 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 241' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 262' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 301' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 322' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.789 0.328 . . . . 54.229999999999997 111.108 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -126.21 158.86 34.55 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.231 -0.441 . . . . 54.409999999999997 110.899 179.93 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 32.8 mt-30 -67.5 -74.03 0.13 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.181 -0.463 . . . . 71.420000000000002 110.92 -179.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 11.2 mt -126.03 150.6 47.99 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.213 -0.449 . . . . 72.310000000000002 110.878 -179.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 17.3 p -119.12 171.73 8.07 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.139 -0.482 . . . . 73.299999999999997 111.152 179.911 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -55.44 -32.03 62.41 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.22 -0.445 . . . . 73.340000000000003 110.866 -179.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -66.97 -37.19 83.8 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.162 -0.472 . . . . 64.219999999999999 110.925 -179.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 7.0 tp60 -78.1 -41.45 35.19 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.127 -0.488 . . . . 74.030000000000001 110.898 -179.923 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 78.3 mt -69.35 -40.61 80.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.195 -0.457 . . . . 72.450000000000003 111.147 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -53.21 -31.4 42.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.133 -0.485 . . . . 63.539999999999999 111.105 179.787 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -74.12 -39.36 63.4 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.225 -0.443 . . . . 73.120000000000005 110.913 -179.924 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 24.7 m-85 -72.25 -45.89 58.28 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.189 -0.459 . . . . 74.230000000000004 110.918 -179.954 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 24.2 ttpp -67.45 -26.75 66.55 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.148 -0.478 . . . . 72.129999999999995 110.88 179.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -67.02 -38.64 86.29 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.256 -0.429 . . . . 75.120000000000005 110.866 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -64.01 -34.06 77.15 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.122 -0.49 . . . . 73.030000000000001 111.121 179.887 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 51.7 t80 -57.3 -53.87 53.18 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.224 -0.444 . . . . 65.200000000000003 110.832 -179.895 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.7 t -52.6 -29.66 27.08 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.175 -0.466 . . . . 54.530000000000001 110.843 -179.785 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 15.6 tp -67.12 -48.17 68.9 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.141 -0.481 . . . . 71.439999999999998 110.91 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 44.5 m-85 -71.78 -25.34 61.98 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.227 -0.442 . . . . 75.319999999999993 110.886 179.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 8.1 t0 -82.54 98.56 9.02 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.139 -0.482 . . . . 73.129999999999995 110.903 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 21.7 ttmm -69.21 -53.46 19.84 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.206 -0.452 . . . . 72.030000000000001 110.888 179.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 9.7 p30 -76.78 -10.09 59.13 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.24 -0.436 . . . . 41.409999999999997 110.833 179.915 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 52.15 46.49 56.47 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.701 -0.761 . . . . 62.020000000000003 112.501 -179.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 38.4 p-10 -89.08 -12.47 41.11 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.845 0.355 . . . . 75.219999999999999 110.853 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 105.44 -11.69 47.18 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.72 -0.752 . . . . 64.319999999999993 112.477 -179.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 56.0 p -133.59 130.69 38.71 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.788 0.328 . . . . 75.129999999999995 111.125 -179.827 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 47.3 mt -84.45 125.7 40.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.193 -0.458 . . . . 75.439999999999998 111.123 179.908 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 28.3 p -107.81 171.09 7.59 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.158 -0.474 . . . . 73.109999999999999 111.109 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 16.3 p -54.21 -45.02 72.14 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.158 -0.474 . . . . 75.109999999999999 111.187 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 4.9 tmtm? -60.14 -37.3 79.67 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.177 -0.465 . . . . 74.040000000000006 110.911 179.91 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -74.0 -32.86 63.59 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.265 -0.425 . . . . 73.430000000000007 110.89 179.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -74.28 -39.98 62.59 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.169 -0.469 . . . . 73.420000000000002 110.892 -179.967 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -71.58 -38.03 61.78 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.735 -0.745 . . . . 71.129999999999995 112.537 179.87 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 96.1 m -62.79 -55.96 21.75 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.817 0.341 . . . . 72.420000000000002 111.185 -179.899 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 71.4 t -54.63 -51.79 47.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.208 -0.451 . . . . 74.409999999999997 111.13 179.875 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 26.4 mtp -52.08 -31.51 30.71 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.205 -0.452 . . . . 73.200000000000003 110.884 179.91 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 45.4 ttp180 -63.37 -43.92 96.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.245 -0.434 . . . . 74.530000000000001 110.865 -179.912 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.3 p -65.25 -34.22 77.85 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.163 -0.472 . . . . 75.439999999999998 110.85 -179.779 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 32.1 mt -72.11 -19.84 61.73 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.176 -0.465 . . . . 74.319999999999993 110.892 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 101.46 30.07 6.05 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.772 -0.728 . . . . 73.200000000000003 112.52 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 83.9 mm-40 -118.64 132.59 56.18 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.798 0.332 . . . . 75.310000000000002 110.928 -179.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 33.5 t-20 -109.88 76.63 0.98 Allowed Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.618 0.723 . . . . 64.430000000000007 110.864 -179.9 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.73 164.65 33.73 Favored 'Trans proline' 0 C--N 1.341 0.17 0 C-N-CA 122.69 2.26 . . . . 73.230000000000004 112.36 179.94 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 19.6 p -112.93 166.41 11.42 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.211 -0.45 . . . . 72.230000000000004 111.172 179.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -59.17 -42.26 90.4 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.229 -0.441 . . . . 75.150000000000006 110.891 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.23 -31.58 64.23 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.153 -0.476 . . . . 53.310000000000002 111.079 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -71.88 -52.1 19.01 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.212 -0.449 . . . . 62.200000000000003 110.893 -179.92 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 18.8 mt -56.09 -51.78 66.64 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.16 -0.473 . . . . 74.439999999999998 110.953 179.985 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 28.6 tp60 -52.85 -29.19 26.52 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.174 -0.466 . . . . 62.43 110.935 179.931 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -75.5 -43.4 49.32 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.213 -0.449 . . . . 72.239999999999995 110.892 179.915 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 68.2 mtp -58.31 -58.04 10.26 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.149 -0.478 . . . . 75.120000000000005 110.891 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 79.6 mt -55.89 -42.06 69.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.19 -0.459 . . . . 73.420000000000002 111.115 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 63.4 m-20 -60.51 -31.28 70.34 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.15 -0.477 . . . . 75.219999999999999 110.877 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -71.26 -23.29 61.95 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.196 -0.456 . . . . 75.010000000000005 110.912 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 2.9 m -114.0 10.87 8.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.15 -0.477 . . . . 64.430000000000007 111.135 179.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 23.2 t0 -90.16 97.67 11.32 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.156 -0.475 . . . . 72.340000000000003 110.868 179.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.29 -44.27 10.94 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.247 -0.433 . . . . 62.030000000000001 111.106 179.946 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 6.4 p-10 -83.09 -0.22 48.07 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.205 -0.452 . . . . 73.040000000000006 110.865 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 51.6 57.38 12.29 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.712 -0.756 . . . . 62.200000000000003 112.485 -179.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 53.1 p-10 -114.56 -15.72 11.97 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.853 0.359 . . . . 74.310000000000002 110.845 -179.848 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 89.28 17.81 54.62 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.771 -0.728 . . . . 72.230000000000004 112.459 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 28.5 p -150.15 158.67 44.4 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.74 0.305 . . . . 75.530000000000001 111.145 -179.868 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 7.6 mm -94.6 110.12 23.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.267 -0.424 . . . . 72.510000000000005 111.14 179.924 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -77.47 -172.79 2.65 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.151 -0.477 . . . . 75.349999999999994 110.837 179.9 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.524 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 2.5 t80 -64.59 -58.31 13.92 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.621 0.724 . . . . 73.319999999999993 110.852 -179.942 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . 0.524 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 54.2 Cg_endo -69.76 -29.9 23.13 Favored 'Trans proline' 0 N--CA 1.465 -0.159 0 C-N-CA 122.698 2.265 . . . . 63.409999999999997 112.372 -179.981 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 11.5 mt-10 -57.17 -41.63 79.63 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.177 -0.465 . . . . 73.450000000000003 110.865 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 5.7 t80 -72.77 -36.12 67.58 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.166 -0.47 . . . . 72.099999999999994 110.845 -179.898 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 19.2 tp -65.42 -53.76 38.33 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.139 -0.482 . . . . 74.519999999999996 110.91 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 9.4 t -55.24 -28.38 52.83 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.212 -0.449 . . . . 71.439999999999998 111.157 179.944 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 6.2 tmm? -68.12 -40.07 82.58 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.181 -0.463 . . . . 73.120000000000005 110.897 179.911 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -79.85 -33.57 40.06 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.194 -0.457 . . . . 71.409999999999997 110.861 179.967 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -74.91 -33.68 62.05 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.22 -0.446 . . . . 63.310000000000002 111.075 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 6.1 ttt85 -60.54 -20.26 59.73 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.215 -0.448 . . . . 71.439999999999998 110.939 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 20.7 ttpp -51.59 -30.11 19.86 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.161 -0.472 . . . . 74.510000000000005 110.86 179.985 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 7.2 ttm -53.3 -54.54 34.91 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.257 -0.429 . . . . 74.329999999999998 110.855 179.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -157.48 164.03 37.84 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.226 -0.443 . . . . 73.129999999999995 110.91 179.952 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 26.5 t0 63.25 75.92 0.38 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.244 -0.435 . . . . 64.340000000000003 110.863 179.825 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 2.0 t 179.23 73.04 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.18 -0.464 . . . . 72.209999999999994 111.152 -179.842 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -179.18 -41.56 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.242 -0.435 . . . . 70.349999999999994 110.857 179.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 1.9 t -52.1 -47.19 65.38 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.177 -0.465 . . . . 72.010000000000005 110.904 -179.78 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -52.04 -59.92 3.8 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.128 -0.487 . . . . 73.120000000000005 110.914 -179.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 14.3 tp10 -58.68 -35.72 73.05 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.145 -0.48 . . . . 72.010000000000005 110.929 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 13.2 tp10 -61.35 -39.76 91.78 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.109 -0.496 . . . . 75.420000000000002 110.896 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 53.2 mt -75.03 -49.49 28.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.158 -0.473 . . . . 70.549999999999997 111.134 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 12.2 ttt180 -62.21 -28.33 69.61 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.146 -0.479 . . . . 73.109999999999999 110.858 179.977 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -70.21 -58.38 3.84 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.221 -0.445 . . . . 75.409999999999997 110.91 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -54.29 -45.39 72.5 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.095 -0.502 . . . . 75.200000000000003 111.107 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 6.7 t80 -52.06 -51.33 58.24 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.211 -0.449 . . . . 74.230000000000004 110.909 -179.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 13.2 ttt85 -61.68 -40.52 95.26 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.121 -0.49 . . . . 73.530000000000001 110.869 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 39.0 t -59.45 -51.15 76.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.214 -0.448 . . . . 75.209999999999994 111.137 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 11.8 m-85 -68.56 -29.04 67.51 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.159 -0.473 . . . . 74.299999999999997 110.838 -179.972 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 33.1 t0 -70.45 94.09 0.94 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.158 -0.473 . . . . 65.209999999999994 110.881 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 2.6 mptm? -78.67 -52.09 8.92 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.215 -0.448 . . . . 75.420000000000002 110.869 -179.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 47.6 p30 -72.5 -9.17 58.23 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.219 -0.446 . . . . 73.319999999999993 110.895 179.86 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 59.95 28.71 66.54 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.7 -0.762 . . . . 71.310000000000002 112.521 -179.924 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 45.3 p-10 -82.39 -16.25 49.77 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.882 0.372 . . . . 74.030000000000001 110.896 -179.882 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 88.56 18.66 54.49 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.717 -0.754 . . . . 42.310000000000002 112.452 179.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 13.4 m-85 -136.03 159.41 41.78 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.841 0.353 . . . . 75.420000000000002 110.949 -179.827 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 71.4 mt -122.04 120.84 62.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.119 -0.491 . . . . 74.530000000000001 111.159 179.87 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 4.9 p -114.9 175.0 5.69 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.189 -0.46 . . . . 74.310000000000002 110.864 -179.905 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -66.15 -25.17 66.84 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.119 -0.491 . . . . 73.010000000000005 111.064 179.927 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -71.07 -49.94 39.22 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.228 -0.442 . . . . 75.200000000000003 111.125 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -76.97 -48.05 19.11 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.228 -0.442 . . . . 75.329999999999998 110.899 -179.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 19.0 tp -53.14 -40.45 64.27 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.155 -0.475 . . . . 74.400000000000006 110.907 -179.957 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 41.6 ttp180 -56.49 -49.43 74.71 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.155 -0.475 . . . . 72.430000000000007 110.894 179.938 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 6.2 t60 -54.28 -36.46 63.68 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.171 -0.468 . . . . 73.230000000000004 110.818 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 85.7 t -63.53 -51.66 67.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.219 -0.446 . . . . 72.129999999999995 111.129 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 5.4 mmt -60.58 -26.02 66.64 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.239 -0.437 . . . . 75.439999999999998 110.866 179.931 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 1.6 m -66.77 -45.2 79.28 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.206 -0.452 . . . . 65.349999999999994 111.164 -179.956 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 5.6 t30 -55.29 -30.62 60.52 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.245 -0.434 . . . . 63.240000000000002 110.868 179.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 7.8 mt -75.42 -25.41 57.5 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.227 -0.442 . . . . 71.120000000000005 110.945 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 101.02 32.98 5.12 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.706 -0.759 . . . . 71.340000000000003 112.487 179.866 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -124.25 109.96 14.04 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.873 0.368 . . . . 75.25 110.865 -179.8 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 19.2 mmtm -74.76 128.62 36.0 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.143 -0.48 . . . . 71.409999999999997 110.904 179.957 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 10.4 mt -133.17 126.69 32.2 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.235 -0.438 . . . . 75.209999999999994 110.904 179.954 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 68.6 p -79.3 -175.06 4.48 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.212 -0.449 . . . . 70.540000000000006 111.109 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -59.84 -40.26 87.92 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.18 -0.464 . . . . 71.510000000000005 110.865 179.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -75.71 -33.39 60.32 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.253 -0.431 . . . . 73.420000000000002 110.86 -179.912 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 46.8 tt0 -71.98 -38.17 69.74 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.163 -0.471 . . . . 71.299999999999997 110.894 -179.931 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 92.8 t -74.31 -30.55 26.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.181 -0.463 . . . . 75.239999999999995 111.109 179.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -78.54 -28.29 46.07 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.2 -0.455 . . . . 74.099999999999994 110.839 179.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 23.0 tp10 -55.52 -49.99 71.16 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.224 -0.444 . . . . 73.150000000000006 110.904 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 13.6 ptm -66.42 -44.12 83.83 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.156 -0.474 . . . . 73.019999999999996 110.922 179.953 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 29.3 mm -53.87 -35.38 27.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.175 -0.466 . . . . 75.340000000000003 111.138 179.945 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 14.1 ttt85 -67.18 -31.7 72.28 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.187 -0.46 . . . . 75.209999999999994 110.867 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 13.1 tp10 -69.14 -45.16 70.8 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.18 -0.464 . . . . 72.329999999999998 110.923 -179.975 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -77.12 -33.18 56.88 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.154 -0.476 . . . . 72.409999999999997 111.091 179.918 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 47.6 t0 -68.9 85.99 0.34 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.258 -0.428 . . . . 72.230000000000004 110.836 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 57.0 mt -79.69 -45.55 23.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.218 -0.446 . . . . 72.040000000000006 111.135 179.977 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 24.5 p30 -72.87 -8.63 56.46 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.175 -0.466 . . . . 61.340000000000003 110.854 179.849 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 62.72 41.91 99.77 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.793 -0.718 . . . . 52.509999999999998 112.463 -179.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 13.3 p-10 -87.6 -15.84 36.21 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.843 0.354 . . . . 75.230000000000004 110.851 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 102.41 4.23 49.99 Favored Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.687 -0.768 . . . . 72.439999999999998 112.482 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -149.19 172.18 15.26 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.861 0.362 . . . . 75.209999999999994 110.909 -179.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 136' ' ' VAL . . . . . . . . . . . . . 99.6 t -110.83 113.75 45.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.185 -0.461 . . . . 71.540000000000006 111.128 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 14.0 p30 -91.02 167.87 12.07 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.132 -0.486 . . . . 74.310000000000002 110.885 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 88.7 t80 -52.08 -47.17 65.32 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.171 -0.468 . . . . 72.030000000000001 110.92 -179.909 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 26.1 tp10 -52.53 -51.78 57.95 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.104 -0.498 . . . . 64.200000000000003 110.844 -179.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 51.7 mt-10 -66.16 -39.88 90.11 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.179 -0.464 . . . . 73.439999999999998 110.899 -179.919 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 75.7 t80 -59.45 -49.16 78.86 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.181 -0.463 . . . . 75.430000000000007 110.879 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 91.8 t -56.58 -40.08 66.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.164 -0.471 . . . . 75.430000000000007 111.162 179.94 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 6.9 tp-100 -70.01 -28.34 65.42 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.179 -0.464 . . . . 75.25 110.895 179.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 9.5 tpt -74.6 -54.03 8.24 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.229 -0.441 . . . . 72.340000000000003 110.89 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 7.7 ttm -66.88 -27.17 67.29 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.218 -0.446 . . . . 73.140000000000001 110.875 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 2.3 m -108.75 21.23 17.52 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.233 -0.439 . . . . 75.030000000000001 111.139 -179.888 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -60.24 -172.0 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.241 -0.436 . . . . 53.009999999999998 111.073 179.883 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.303 0 CA-C-N 116.196 -0.456 . . . . 72.420000000000002 110.918 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' M' M ' 8' ' ' LEU . . . . . . . . . . . . . 17.0 mt . . . . . 0 C--O 1.231 0.108 0 CA-C-O 120.796 0.331 . . . . 71.230000000000004 110.909 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' M' M ' 9' ' ' SER . . . . . . . . . . . . . 5.4 t -174.4 81.73 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.18 -0.464 . . . . 63.43 110.89 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' M' M ' 10' ' ' GLY . . . . . . . . . . . . . . . -175.54 -148.6 6.91 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.769 -0.729 . . . . 74.049999999999997 112.519 -179.944 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' M' M ' 11' ' ' GLY . . . . . . . . . . . . . . . -138.5 22.91 3.0 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.761 -0.733 . . . . 64.239999999999995 112.502 -179.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' M' M ' 12' ' ' GLU . . . . . . . . . . . . . 28.2 mm-40 -100.7 167.6 10.22 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.873 0.368 . . . . 74.140000000000001 110.866 -179.852 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' M' M ' 13' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -87.74 76.23 8.84 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.14 -0.482 . . . . 74.329999999999998 110.936 -179.955 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' M' M ' 14' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -102.47 24.32 10.56 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.186 -0.461 . . . . 74.409999999999997 110.87 179.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' M' M ' 15' ' ' LYS . . . . . . . . . . . . . 24.1 mttp -79.1 -49.9 11.89 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.204 -0.453 . . . . 74.129999999999995 110.852 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' M' M ' 16' ' ' TRP . . . . . . . . . . . . . 46.2 m95 -52.77 -40.55 63.26 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.217 -0.447 . . . . 74.109999999999999 110.904 179.972 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' M' M ' 17' ' ' GLU . . . . . . . . . . . . . 28.5 tt0 -55.43 -26.28 41.0 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.234 -0.439 . . . . 71.140000000000001 110.87 -179.948 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' M' M ' 18' ' ' LYS . . . . . . . . . . . . . 16.2 ttpp -77.65 -28.02 51.16 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.145 -0.48 . . . . 75.409999999999997 110.841 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' M' M ' 19' ' ' ILE . . . . . . . . . . . . . 60.2 mt -78.3 -29.38 15.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.22 -0.446 . . . . 74.439999999999998 111.164 179.894 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' M' M ' 20' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -54.02 -28.71 40.01 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.157 -0.474 . . . . 72.540000000000006 110.906 179.906 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' M' M ' 21' ' ' LEU . . . . . . . . . . . . . 5.0 mt 57.59 -179.99 0.06 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.186 -0.461 . . . . 72.109999999999999 110.903 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' M' M ' 22' ' ' ARG . . . . . 0.401 ' N ' ' CD ' ' M' ' 23' ' ' PRO . 25.0 ptt180 -173.48 57.02 0.21 Allowed Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.533 0.682 . . . . 74.430000000000007 110.873 179.96 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' M' M ' 23' ' ' PRO . . . . . 0.401 ' CD ' ' N ' ' M' ' 22' ' ' ARG . 53.8 Cg_endo -69.7 174.83 8.88 Favored 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.671 2.248 . . . . 71.129999999999995 112.352 179.993 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' M' M ' 24' ' ' GLY . . . . . . . . . . . . . . . -111.89 41.55 2.2 Favored Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.692 -0.766 . . . . 62.329999999999998 112.438 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' M' M ' 25' ' ' GLY . . . . . . . . . . . . . . . -69.54 -144.62 0.19 Allowed Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.743 -0.741 . . . . 42.399999999999999 112.504 -179.937 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' M' M ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -156.15 -175.99 5.72 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.829 0.347 . . . . 72.400000000000006 110.885 -179.94 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' M' M ' 27' ' ' LYS . . . . . . . . . . . . . 10.1 mttp -51.76 149.98 4.32 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.203 -0.453 . . . . 72.400000000000006 110.893 179.851 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' M' M ' 28' ' ' GLN . . . . . . . . . . . . . 27.8 mm100 -149.59 102.25 3.15 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.248 -0.433 . . . . 75.530000000000001 110.959 179.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' M' M ' 29' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -113.47 -25.54 8.73 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.237 -0.438 . . . . 70.549999999999997 110.953 -179.832 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' M' M ' 30' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 62.88 20.55 12.28 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.083 -0.508 . . . . 74.420000000000002 110.905 179.916 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' M' M ' 31' ' ' LEU . . . . . . . . . . . . . 25.9 tp -141.72 -55.44 0.46 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.258 -0.428 . . . . 72.439999999999998 110.897 179.938 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' M' M ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.68 -45.38 48.71 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.183 -0.462 . . . . 65.340000000000003 110.909 179.851 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' M' M ' 33' ' ' HIS . . . . . . . . . . . . . 19.0 t-80 -50.36 -36.91 34.42 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.166 -0.47 . . . . 74.239999999999995 110.864 179.897 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' M' M ' 34' ' ' ILE . . . . . . . . . . . . . 49.7 mm -49.74 -40.83 16.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.191 -0.459 . . . . 74.129999999999995 111.171 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' M' M ' 35' ' ' VAL . . . . . . . . . . . . . 65.9 t -49.26 -40.63 13.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.15 -0.477 . . . . 74.030000000000001 111.176 179.772 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' M' M ' 36' ' ' TRP . . . . . . . . . . . . . 28.8 m0 -59.31 -38.88 81.35 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.14 -0.482 . . . . 75.299999999999997 110.965 179.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' M' M ' 37' ' ' ALA . . . . . . . . . . . . . . . -63.9 -18.61 64.37 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.167 -0.47 . . . . 73.0 111.108 179.876 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' M' M ' 38' ' ' SER . . . . . . . . . . . . . 2.5 m -70.61 -17.97 62.89 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.234 -0.439 . . . . 61.240000000000002 110.86 -179.82 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' M' M ' 39' ' ' ARG . . . . . . . . . . . . . 16.2 mmm180 -60.13 -26.8 66.54 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.176 -0.466 . . . . 75.430000000000007 110.878 -179.932 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' M' M ' 40' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -74.63 -47.76 30.28 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.205 -0.452 . . . . 64.400000000000006 110.908 -179.946 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' M' M ' 41' ' ' LEU . . . . . . . . . . . . . 15.3 mt -53.31 171.37 0.08 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.17 -0.468 . . . . 72.219999999999999 110.92 -179.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' M' M ' 42' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -133.5 27.69 4.04 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.21 -0.45 . . . . 73.510000000000005 110.908 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' M' M ' 43' ' ' ARG . . . . . . . . . . . . . 11.4 ttt85 . . . . . 0 C--N 1.329 -0.317 0 CA-C-N 116.093 -0.503 . . . . 73.450000000000003 110.886 -179.914 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 241' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 262' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 301' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 322' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.103 0 CA-C-O 120.772 0.32 . . . . 73.319999999999993 111.079 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 19.7 m-20 -129.05 51.53 2.04 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.242 -0.436 . . . . 52.43 110.877 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 11.4 tp60 -135.58 115.71 13.33 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.188 -0.46 . . . . 70.140000000000001 110.902 -179.888 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 10.5 mt -100.25 164.22 12.05 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.17 -0.468 . . . . 63.130000000000003 110.895 -179.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 78.5 p -121.67 171.95 8.48 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.198 -0.455 . . . . 62.020000000000003 111.144 179.937 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 12.0 tp10 -53.34 -28.66 29.95 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.249 -0.432 . . . . 72.140000000000001 110.886 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 8.0 tm-20 -66.79 -39.13 87.66 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.127 -0.488 . . . . 74.319999999999993 110.92 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 7.5 tp60 -77.75 -41.95 35.8 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.088 -0.506 . . . . 63.509999999999998 110.893 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 41.4 mt -68.58 -37.09 77.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.209 -0.451 . . . . 75.340000000000003 111.12 179.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -52.0 -33.16 37.03 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.15 -0.477 . . . . 75.319999999999993 111.139 179.815 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 16.2 mm-40 -74.9 -51.87 12.73 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.203 -0.453 . . . . 75.409999999999997 110.878 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 64.5 m-85 -58.18 -46.03 86.47 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.191 -0.459 . . . . 73.519999999999996 110.888 -179.925 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 19.5 ttmm -54.18 -30.45 49.58 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.159 -0.473 . . . . 75.129999999999995 110.886 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -70.84 -30.69 67.18 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.223 -0.444 . . . . 65.209999999999994 110.87 179.946 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -67.02 -48.16 69.22 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.16 -0.473 . . . . 73.140000000000001 111.083 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 79.2 t80 -56.09 -54.28 46.97 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.2 -0.454 . . . . 63.439999999999998 110.891 -179.932 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 20.6 t -58.99 -26.49 64.54 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.174 -0.466 . . . . 53.340000000000003 110.88 -179.8 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 1.2 tt -68.75 -37.33 79.31 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.117 -0.492 . . . . 73.140000000000001 110.909 -179.999 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 22.3 m-85 -81.33 -39.09 25.65 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.19 -0.459 . . . . 75.430000000000007 110.88 179.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 26.5 t0 -62.97 98.56 0.13 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.164 -0.471 . . . . 73.549999999999997 110.906 179.931 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.14 -56.05 6.24 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.223 -0.444 . . . . 75.129999999999995 110.919 179.978 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 2.3 p-10 -70.86 -10.45 59.62 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.212 -0.449 . . . . 70.230000000000004 110.859 179.901 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 50.86 66.43 2.47 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.708 -0.758 . . . . 74.019999999999996 112.496 -179.93 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 35.3 p-10 -114.47 -15.71 12.02 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.828 0.347 . . . . 72.310000000000002 110.848 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 100.53 10.28 44.62 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.755 -0.736 . . . . 75.230000000000004 112.457 -179.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 51.0 p -151.29 130.7 12.91 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.771 0.319 . . . . 62.109999999999999 111.135 -179.865 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 22.5 mt -91.08 121.78 41.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.218 -0.446 . . . . 74.040000000000006 111.071 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 30.0 p -107.77 172.82 6.62 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.153 -0.476 . . . . 63.210000000000001 111.128 179.932 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 71.4 p -61.41 -27.55 68.61 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.201 -0.454 . . . . 75.0 111.164 -179.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 19.5 mmmt -75.7 -35.19 60.36 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.223 -0.444 . . . . 64.430000000000007 110.93 179.909 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 -76.06 -32.66 59.4 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.19 -0.459 . . . . 74.319999999999993 110.898 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -67.15 -39.79 86.6 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.123 -0.49 . . . . 65.200000000000003 110.93 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -67.92 -35.51 84.68 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.71 -0.757 . . . . 75.140000000000001 112.528 179.849 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 74.6 m -62.81 -55.47 26.11 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.808 0.337 . . . . 62.229999999999997 111.158 -179.876 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 92.4 t -65.28 -53.32 41.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.248 -0.433 . . . . 75.349999999999994 111.109 179.901 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -51.9 -31.5 28.66 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.179 -0.464 . . . . 75.519999999999996 110.884 179.947 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 48.6 ttt180 -65.95 -47.09 75.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.221 -0.445 . . . . 74.040000000000006 110.897 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.3 p -63.66 -33.67 76.15 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.159 -0.473 . . . . 65.040000000000006 110.888 -179.81 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 57.7 mt -68.09 -22.11 64.93 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.1 -0.5 . . . . 73.019999999999996 110.91 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 101.43 31.37 5.56 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.729 -0.748 . . . . 74.340000000000003 112.505 179.915 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 13.9 mt-30 -128.29 118.62 23.57 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.793 0.33 . . . . 64.010000000000005 110.911 -179.896 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 1.2 t30 -109.86 76.92 1.0 Allowed Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.65 0.738 . . . . 71.319999999999993 110.86 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.85 168.08 22.71 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.695 2.263 . . . . 71.5 112.297 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 30.9 p -90.78 161.69 15.18 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.234 -0.439 . . . . 71.319999999999993 111.081 -179.91 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 25.2 tt0 -51.95 -43.7 63.62 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.157 -0.474 . . . . 72.329999999999998 110.883 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.14 -31.49 64.3 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.142 -0.481 . . . . 72.340000000000003 111.063 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 53.7 tt0 -65.96 -48.25 71.93 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.238 -0.437 . . . . 73.400000000000006 110.917 -179.938 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 46.4 mt -55.34 -35.35 65.09 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.152 -0.476 . . . . 75.200000000000003 110.932 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 43.8 tp60 -70.92 -28.96 64.9 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.184 -0.462 . . . . 74.310000000000002 110.873 179.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 29.3 t0 -68.73 -46.61 68.47 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.216 -0.447 . . . . 65.150000000000006 110.869 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 10.7 mtp -60.18 -53.0 62.9 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.184 -0.462 . . . . 75.430000000000007 110.877 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 73.3 mt -60.46 -41.25 86.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.226 -0.443 . . . . 63.409999999999997 111.159 179.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 70.7 m-20 -67.89 -32.73 73.42 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.155 -0.475 . . . . 74.329999999999998 110.894 179.934 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 18.4 mm-40 -61.01 -23.28 65.29 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.182 -0.463 . . . . 71.420000000000002 110.887 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 3.8 m -112.52 -14.89 10.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.162 -0.472 . . . . 52.439999999999998 111.109 179.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 33.0 t0 -66.79 97.07 0.44 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.172 -0.467 . . . . 74.099999999999994 110.85 179.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.46 -32.71 18.12 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.159 -0.473 . . . . 73.030000000000001 111.074 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -91.69 -0.43 57.56 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.234 -0.439 . . . . 72.25 110.851 179.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 51.46 62.21 5.68 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.699 -0.762 . . . . 41.149999999999999 112.509 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 50.7 p-10 -114.58 -15.75 11.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.864 0.364 . . . . 73.5 110.877 -179.873 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 89.11 15.83 58.54 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.751 -0.738 . . . . 63.100000000000001 112.49 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 30.7 p -152.17 161.54 42.47 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.758 0.313 . . . . 74.540000000000006 111.143 -179.865 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 8.6 mm -99.26 114.8 38.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.194 -0.457 . . . . 72.519999999999996 111.133 179.921 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -81.79 -173.01 4.2 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.153 -0.476 . . . . 63.329999999999998 110.88 179.846 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.521 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 2.5 t80 -66.55 -58.3 10.38 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.669 0.747 . . . . 74.409999999999997 110.857 -179.911 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . 0.521 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 53.1 Cg_endo -69.78 -29.41 23.8 Favored 'Trans proline' 0 C--N 1.342 0.202 0 C-N-CA 122.677 2.251 . . . . 74.510000000000005 112.332 -179.947 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -61.48 -40.26 93.91 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.217 -0.447 . . . . 72.040000000000006 110.896 -179.976 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 14.7 t80 -74.52 -35.56 63.16 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.149 -0.478 . . . . 72.420000000000002 110.886 -179.955 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 19.0 tp -69.98 -54.16 14.49 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.121 -0.49 . . . . 73.510000000000005 110.921 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 14.8 t -51.93 -29.77 21.68 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.146 -0.479 . . . . 75.310000000000002 111.109 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 3.6 tmm? -61.86 -43.4 98.92 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.247 -0.433 . . . . 74.150000000000006 110.844 179.937 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 3.8 mmt -79.85 -29.4 40.06 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.249 -0.432 . . . . 71.310000000000002 110.846 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -74.84 -28.47 60.7 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.233 -0.44 . . . . 75.140000000000001 111.146 179.909 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.11 -19.32 65.81 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.178 -0.465 . . . . 74.109999999999999 110.908 -179.952 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 19.7 pttp -51.44 -30.92 21.18 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.178 -0.465 . . . . 74.010000000000005 110.887 179.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -63.31 -43.46 97.77 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.28 -0.418 . . . . 74.230000000000004 110.904 179.864 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 7.7 ttpt -64.44 172.21 2.73 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.201 -0.454 . . . . 75.439999999999998 110.884 179.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 78.6 m-20 -83.62 136.76 34.1 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.193 -0.458 . . . . 74.510000000000005 110.874 179.891 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -162.17 84.9 0.58 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.2 -0.455 . . . . 72.099999999999994 111.124 -179.857 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -115.36 -29.35 6.58 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.22 -0.445 . . . . 74.200000000000003 110.864 179.902 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 1.5 t -64.77 -52.63 55.91 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.223 -0.444 . . . . 73.0 110.866 -179.771 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 61.7 mm-40 -62.87 -25.99 68.56 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.128 -0.487 . . . . 75.409999999999997 110.89 -179.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 6.5 tm-20 -67.56 -37.5 82.74 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.196 -0.456 . . . . 71.219999999999999 110.892 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 53.6 tp10 -77.67 -30.35 51.96 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.091 -0.504 . . . . 64.510000000000005 110.921 -179.927 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 47.7 mt -69.63 -51.05 45.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.127 -0.488 . . . . 75.310000000000002 111.147 179.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 2.7 ttt180 -61.13 -32.42 72.12 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.167 -0.469 . . . . 75.340000000000003 110.865 179.942 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -76.68 -57.18 4.0 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.224 -0.444 . . . . 65.540000000000006 110.9 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -53.49 -51.03 64.08 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.177 -0.465 . . . . 71.430000000000007 111.081 179.924 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -54.2 -41.79 69.0 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.191 -0.458 . . . . 75.430000000000007 110.878 -179.932 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 73.1 ttt180 -70.41 -27.32 64.19 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.161 -0.472 . . . . 71.129999999999995 110.9 -179.942 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 93.7 t -75.61 -28.26 19.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.178 -0.464 . . . . 62.299999999999997 111.141 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 8.8 m-85 -93.08 -35.64 13.11 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.144 -0.48 . . . . 75.219999999999999 110.898 -179.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 35.1 t0 -64.67 94.16 0.12 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.125 -0.489 . . . . 74.230000000000004 110.857 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 10.1 tppt? -78.64 -51.52 9.76 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.193 -0.458 . . . . 74.349999999999994 110.915 179.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 17.8 p30 -72.7 -9.14 58.28 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.218 -0.446 . . . . 74.299999999999997 110.834 179.919 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 59.76 28.32 65.45 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.713 -0.756 . . . . 63.409999999999997 112.528 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 43.8 p-10 -81.85 -16.18 51.64 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.887 0.375 . . . . 70.109999999999999 110.893 -179.87 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 91.03 18.64 46.05 Favored Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.717 -0.754 . . . . 73.540000000000006 112.5 179.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 12.5 m-85 -136.6 148.18 47.36 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.907 0.384 . . . . 75.319999999999993 110.933 -179.812 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 78.8 mt -113.78 121.33 65.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.139 -0.482 . . . . 74.010000000000005 111.114 179.921 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 17.8 p -116.2 175.25 5.63 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.145 -0.479 . . . . 74.510000000000005 110.859 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -66.33 -33.32 75.48 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.129 -0.487 . . . . 74.340000000000003 111.079 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -61.59 -49.93 74.64 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.251 -0.431 . . . . 73.420000000000002 111.076 179.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 23.7 mt-10 -76.91 -49.18 16.21 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.207 -0.452 . . . . 74.430000000000007 110.925 -179.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 18.9 tp -53.3 -34.49 57.55 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.114 -0.494 . . . . 72.5 110.931 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 57.4 ttp180 -59.8 -48.05 83.23 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.2 -0.455 . . . . 75.25 110.843 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 70.9 t60 -54.38 -34.39 61.12 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.203 -0.453 . . . . 63.240000000000002 110.831 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 42.3 t -65.5 -48.9 81.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.243 -0.435 . . . . 73.420000000000002 111.139 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 7.6 mmt -59.48 -45.06 92.75 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.163 -0.471 . . . . 72.409999999999997 110.866 179.922 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -57.56 -39.11 75.96 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.183 -0.462 . . . . 74.430000000000007 111.183 -179.942 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 10.6 t-20 -74.59 -26.55 59.99 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.168 -0.469 . . . . 72.319999999999993 110.9 179.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 12.3 mt -70.77 -25.97 63.14 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.238 -0.437 . . . . 73.049999999999997 110.903 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 101.01 33.02 5.11 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.724 -0.75 . . . . 74.140000000000001 112.452 179.862 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -124.05 113.43 18.38 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.948 0.404 . . . . 70.530000000000001 110.865 -179.863 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 9.1 pttm -70.32 118.68 13.44 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.131 -0.486 . . . . 75.120000000000005 110.913 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 24.5 mt -137.41 163.3 31.39 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.2 -0.455 . . . . 74.0 110.89 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 65.9 p -113.01 174.45 5.89 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.22 -0.445 . . . . 74.109999999999999 111.132 179.925 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -53.37 -48.11 68.88 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.223 -0.444 . . . . 75.239999999999995 110.875 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 49.9 tt0 -62.47 -38.57 90.35 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.23 -0.441 . . . . 72.120000000000005 110.886 -179.92 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -61.55 -46.77 88.52 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.143 -0.48 . . . . 74.150000000000006 110.897 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 62.1 t -57.07 -32.22 39.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.18 -0.464 . . . . 75.099999999999994 111.127 179.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 3.1 t70 -78.51 -28.49 46.29 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.192 -0.458 . . . . 61.329999999999998 110.88 179.919 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 34.5 tp10 -55.6 -50.0 71.28 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.203 -0.453 . . . . 74.25 110.88 -179.928 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 13.4 ptm -66.61 -44.36 82.29 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.16 -0.473 . . . . 73.230000000000004 110.878 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 28.9 mm -53.88 -35.47 27.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.189 -0.46 . . . . 65.120000000000005 111.099 179.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 18.3 ttt-85 -66.88 -31.58 72.28 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.197 -0.456 . . . . 73.439999999999998 110.868 179.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 6.9 tm-20 -70.36 -47.26 61.79 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.164 -0.471 . . . . 75.150000000000006 110.83 -179.896 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -74.23 -33.8 63.47 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.184 -0.462 . . . . 65.319999999999993 111.068 179.957 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 50.1 t0 -68.54 86.74 0.31 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.257 -0.429 . . . . 62.329999999999998 110.867 -179.999 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 57.7 mt -79.75 -45.61 23.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.182 -0.463 . . . . 75.219999999999999 111.116 -179.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 22.9 p30 -72.73 -8.69 56.62 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.201 -0.454 . . . . 74.319999999999993 110.851 179.864 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 62.31 41.57 99.74 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.769 -0.729 . . . . 72.0 112.517 -179.925 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 34.6 p-10 -86.85 -15.91 37.71 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.851 0.358 . . . . 73.239999999999995 110.848 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 101.93 3.72 51.78 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.76 -0.733 . . . . 62.43 112.47 -179.94 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 3.5 tt0 -149.23 172.22 15.21 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.83 0.348 . . . . 53.329999999999998 110.895 -179.892 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 136' ' ' VAL . . . . . . . . . . . . . 95.0 t -111.66 108.56 25.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.214 -0.448 . . . . 75.349999999999994 111.134 180.0 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 17.5 p30 -86.24 175.62 8.38 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.163 -0.471 . . . . 62.530000000000001 110.877 -179.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 39.6 t80 -60.94 -46.52 90.38 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.193 -0.458 . . . . 74.540000000000006 110.968 -179.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 79.4 tt0 -52.62 -36.45 56.48 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.054 -0.521 . . . . 74.25 110.878 -179.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -78.41 -40.62 35.39 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.145 -0.479 . . . . 75.329999999999998 110.872 -179.911 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 26.7 t80 -62.31 -46.92 86.56 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.177 -0.465 . . . . 74.219999999999999 110.88 -179.891 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 83.1 t -51.61 -46.93 38.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.186 -0.461 . . . . 74.230000000000004 111.164 179.917 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 3.8 tt0 -71.9 -24.96 61.74 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.175 -0.466 . . . . 71.140000000000001 110.939 179.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 7.0 tpt -74.04 -42.36 60.38 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.192 -0.458 . . . . 71.129999999999995 110.883 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -71.77 -27.7 63.14 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.238 -0.437 . . . . 72.230000000000004 110.901 179.926 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 1.8 m -110.41 21.29 16.83 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.239 -0.437 . . . . 72.219999999999999 111.098 -179.885 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -75.48 -175.83 2.96 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.232 -0.44 . . . . 74.129999999999995 111.095 179.858 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 8.9 tptm . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 116.213 -0.449 . . . . 72.140000000000001 110.907 179.924 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' M' M ' 8' ' ' LEU . . . . . . . . . . . . . 5.2 mp . . . . . 0 C--O 1.231 0.1 0 CA-C-O 120.828 0.347 . . . . 74.439999999999998 110.93 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' M' M ' 9' ' ' SER . . . . . . . . . . . . . 6.7 m -63.76 -177.2 0.22 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.242 -0.435 . . . . 74.129999999999995 110.853 -179.946 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' M' M ' 10' ' ' GLY . . . . . . . . . . . . . . . 173.8 -160.62 30.75 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.737 -0.744 . . . . 70.120000000000005 112.468 -179.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' M' M ' 11' ' ' GLY . . . . . . . . . . . . . . . -91.46 -82.62 1.44 Allowed Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.731 -0.747 . . . . 31.210000000000001 112.517 -179.926 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' M' M ' 12' ' ' GLU . . . . . . . . . . . . . 10.1 mt-10 -60.9 -172.94 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.834 0.35 . . . . 74.540000000000006 110.87 -179.859 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' M' M ' 13' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -87.99 75.63 8.74 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.179 -0.464 . . . . 75.540000000000006 110.894 -179.967 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' M' M ' 14' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -101.76 24.12 10.34 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.223 -0.444 . . . . 73.530000000000001 110.863 179.858 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' M' M ' 15' ' ' LYS . . . . . . . . . . . . . 7.3 mtmp? -79.09 -39.92 32.53 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.178 -0.464 . . . . 72.519999999999996 110.917 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' M' M ' 16' ' ' TRP . . . . . . . . . . . . . 18.0 m95 -54.6 -41.14 69.57 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.149 -0.478 . . . . 73.299999999999997 110.953 179.917 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' M' M ' 17' ' ' GLU . . . . . . . . . . . . . 15.8 tt0 -57.87 -26.57 62.28 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.215 -0.448 . . . . 71.420000000000002 110.862 -179.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' M' M ' 18' ' ' LYS . . . . . . . . . . . . . 19.8 tttp -73.5 -25.75 60.58 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.165 -0.471 . . . . 64.450000000000003 110.916 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' M' M ' 19' ' ' ILE . . . . . . . . . . . . . 31.5 mt -82.63 -20.96 9.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.194 -0.457 . . . . 73.219999999999999 111.103 179.882 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' M' M ' 20' ' ' ARG . . . . . . . . . . . . . 36.6 ttm180 -72.62 -27.12 61.96 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.199 -0.455 . . . . 75.209999999999994 110.921 179.918 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' M' M ' 21' ' ' LEU . . . . . . . . . . . . . 8.3 mt 52.31 -169.94 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.19 -0.459 . . . . 75.310000000000002 110.957 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' M' M ' 22' ' ' ARG . . . . . . . . . . . . . 30.7 ptt85 -160.53 57.01 0.85 Allowed Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.585 0.707 . . . . 74.530000000000001 110.904 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' M' M ' 23' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.73 -48.29 0.76 Allowed 'Trans proline' 0 N--CA 1.465 -0.168 0 C-N-CA 122.683 2.255 . . . . 74.319999999999993 112.38 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' M' M ' 24' ' ' GLY . . . . . . . . . . . . . . . 133.39 -48.69 0.94 Allowed Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.745 -0.74 . . . . 72.420000000000002 112.514 179.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' M' M ' 25' ' ' GLY . . . . . . . . . . . . . . . 62.03 164.44 0.35 Allowed Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.756 -0.735 . . . . 73.319999999999993 112.477 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' M' M ' 26' ' ' LYS . . . . . . . . . . . . . 42.3 mmtt -151.03 -74.18 0.15 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.889 0.376 . . . . 74.150000000000006 110.954 179.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' M' M ' 27' ' ' LYS . . . . . . . . . . . . . 51.9 mtmt -150.81 134.97 16.86 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.206 -0.452 . . . . 72.299999999999997 110.902 179.813 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' M' M ' 28' ' ' GLN . . . . . . . . . . . . . 4.1 mt-30 -162.28 177.58 9.48 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.207 -0.451 . . . . 74.219999999999999 110.882 179.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' M' M ' 29' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -176.29 140.75 0.4 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.163 -0.471 . . . . 63.32 110.956 -179.82 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' M' M ' 30' ' ' LYS . . . . . . . . . . . . . 11.4 tttm -88.18 50.0 1.9 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.126 -0.488 . . . . 74.299999999999997 110.896 179.946 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' M' M ' 31' ' ' LEU . . . . . . . . . . . . . 10.0 tp 179.72 -47.87 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.265 -0.425 . . . . 74.530000000000001 110.925 179.917 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' M' M ' 32' ' ' LYS . . . . . . . . . . . . . 1.3 ttmm -48.26 -45.8 34.9 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.179 -0.464 . . . . 74.340000000000003 110.879 179.816 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' M' M ' 33' ' ' HIS . . . . . . . . . . . . . 35.1 t60 -49.99 -39.82 42.31 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.211 -0.449 . . . . 74.299999999999997 110.877 179.928 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' M' M ' 34' ' ' ILE . . . . . . . . . . . . . 58.9 mt -50.08 -40.21 16.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.197 -0.456 . . . . 73.219999999999999 111.091 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' M' M ' 35' ' ' VAL . . . . . . . . . . . . . 62.5 t -48.36 -41.29 10.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.227 -0.442 . . . . 74.420000000000002 111.101 179.864 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' M' M ' 36' ' ' TRP . . . . . . . . . . . . . 22.0 m0 -58.43 -40.47 82.6 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.217 -0.447 . . . . 73.409999999999997 110.914 179.988 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' M' M ' 37' ' ' ALA . . . . . . . . . . . . . . . -64.09 -18.85 64.79 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.201 -0.454 . . . . 63.43 111.106 179.888 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' M' M ' 38' ' ' SER . . . . . . . . . . . . . 1.1 m -69.31 -17.94 63.77 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.223 -0.444 . . . . 72.200000000000003 110.84 -179.764 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' M' M ' 39' ' ' ARG . . . . . . . . . . . . . 45.0 mtp180 -71.51 -21.76 61.88 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.163 -0.471 . . . . 74.420000000000002 110.869 -179.93 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' M' M ' 40' ' ' GLU . . . . . . . . . . . . . 22.2 mm-40 -73.94 -48.0 33.71 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.206 -0.452 . . . . 63.009999999999998 110.924 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' M' M ' 41' ' ' LEU . . . . . . . . . . . . . 13.6 mt -53.76 171.97 0.08 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.174 -0.466 . . . . 74.010000000000005 110.939 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' M' M ' 42' ' ' GLU . . . . . . . . . . . . . 88.3 mt-10 -80.18 107.06 12.66 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.217 -0.447 . . . . 62.509999999999998 110.872 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' M' M ' 43' ' ' ARG . . . . . . . . . . . . . 61.7 mtm180 . . . . . 0 C--N 1.329 -0.3 0 CA-C-N 116.164 -0.471 . . . . 74.150000000000006 110.841 -179.911 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 241' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 262' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 301' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 322' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.126 0 CA-C-O 120.757 0.313 . . . . 74.230000000000004 111.122 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 64.2 m-20 59.84 30.8 20.35 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.233 -0.44 . . . . 74.200000000000003 110.908 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 65.9 mt-30 -67.94 161.17 27.08 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.167 -0.47 . . . . 74.310000000000002 110.925 -179.911 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 10.5 mt -127.28 147.71 50.23 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.246 -0.434 . . . . 74.430000000000007 110.916 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 29.8 p -110.25 177.07 4.81 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.183 -0.462 . . . . 63.0 111.128 179.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -56.26 -29.51 61.19 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.184 -0.462 . . . . 74.420000000000002 110.859 -179.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 21.5 tt0 -67.53 -35.59 79.39 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.179 -0.464 . . . . 74.5 110.907 -179.948 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 1.2 tp-100 -77.28 -42.58 36.47 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.172 -0.467 . . . . 74.219999999999999 110.899 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 54.6 mt -69.68 -40.12 78.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.252 -0.431 . . . . 70.450000000000003 111.156 179.931 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.63 -26.05 66.74 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.135 -0.484 . . . . 71.310000000000002 111.085 179.847 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 15.4 mm-40 -74.15 -51.93 14.07 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.261 -0.427 . . . . 73.230000000000004 110.867 -179.92 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 16.6 m-85 -69.03 -38.06 78.97 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.213 -0.449 . . . . 65.129999999999995 110.902 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 19.7 ttmt -52.09 -50.38 61.73 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.141 -0.481 . . . . 74.430000000000007 110.928 179.932 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -56.54 -37.25 70.24 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.171 -0.468 . . . . 63.329999999999998 110.885 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -59.6 -25.56 64.72 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.169 -0.469 . . . . 72.120000000000005 111.071 179.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 73.8 t80 -70.94 -54.03 12.84 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.215 -0.448 . . . . 73.540000000000006 110.842 -179.895 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 74.9 m -52.79 -31.37 38.23 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.131 -0.486 . . . . 73.329999999999998 110.892 -179.768 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 16.3 tp -63.07 -39.93 96.18 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.101 -0.499 . . . . 74.420000000000002 110.902 -179.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 33.7 m-85 -79.61 -35.88 38.86 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.213 -0.449 . . . . 72.349999999999994 110.899 179.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 16.1 t0 -67.56 98.51 0.68 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.165 -0.47 . . . . 64.040000000000006 110.919 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 3.2 tppt? -70.28 -54.31 13.22 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.209 -0.45 . . . . 74.109999999999999 110.911 -179.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 19.3 p-10 -75.73 -10.04 59.1 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.221 -0.445 . . . . 60.109999999999999 110.88 179.848 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 52.18 46.09 56.95 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.732 -0.747 . . . . 73.400000000000006 112.482 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 25.0 p-10 -93.59 -15.75 25.08 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.854 0.359 . . . . 72.200000000000003 110.891 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 100.32 18.04 22.75 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.789 -0.719 . . . . 51.130000000000003 112.479 -179.942 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -154.62 130.82 10.35 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.776 0.322 . . . . 73.510000000000005 111.142 -179.858 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 25.6 mt -94.25 119.84 42.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.205 -0.452 . . . . 74.400000000000006 111.182 179.896 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 20.2 p -107.61 176.24 5.22 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.182 -0.463 . . . . 74.239999999999995 111.166 -179.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 1.5 p -66.8 -33.95 76.74 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.26 -0.427 . . . . 72.420000000000002 111.14 -179.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 45.3 mtmt -61.44 -50.13 74.02 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.237 -0.438 . . . . 74.349999999999994 110.879 179.923 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 8.2 mt-10 -76.06 -52.88 9.24 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.244 -0.435 . . . . 72.439999999999998 110.893 179.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -53.34 -40.67 65.07 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.169 -0.468 . . . . 73.420000000000002 110.922 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -70.15 -30.66 69.5 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.785 -0.721 . . . . 72.099999999999994 112.491 179.893 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 96.6 m -74.48 -46.13 41.58 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.771 0.32 . . . . 74.310000000000002 111.12 -179.862 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 47.4 t -51.54 -47.37 36.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.233 -0.44 . . . . 75.099999999999994 111.144 179.892 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -56.22 -34.8 66.64 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.2 -0.454 . . . . 75.430000000000007 110.869 179.89 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 42.1 ttt-85 -56.41 -40.36 74.56 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.229 -0.442 . . . . 75.239999999999995 110.911 -179.912 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 5.2 t -76.54 -26.26 54.97 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.181 -0.463 . . . . 72.430000000000007 110.839 -179.807 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 60.9 mt -81.48 -21.92 38.4 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.116 -0.493 . . . . 71.099999999999994 110.933 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 101.45 31.32 5.57 Favored Glycine 0 N--CA 1.452 -0.251 0 C-N-CA 120.722 -0.751 . . . . 45.140000000000001 112.477 179.856 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 5.7 mm100 -122.62 124.82 44.35 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.796 0.331 . . . . 75.010000000000005 110.923 -179.895 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 1.1 t30 -109.87 76.58 0.97 Allowed Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.603 0.716 . . . . 74.430000000000007 110.911 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.71 167.97 22.82 Favored 'Trans proline' 0 C--O 1.232 0.177 0 C-N-CA 122.675 2.25 . . . . 72.019999999999996 112.397 179.908 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 20.0 p -110.07 154.14 23.66 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.228 -0.442 . . . . 71.099999999999994 111.138 -179.963 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 20.5 tt0 -51.91 -38.84 57.78 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.222 -0.445 . . . . 71.310000000000002 110.895 -179.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.33 -31.61 64.08 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.127 -0.488 . . . . 73.040000000000006 111.075 179.9 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -72.77 -52.6 14.39 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.209 -0.45 . . . . 65.409999999999997 110.895 -179.9 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 9.3 mt -55.15 -38.39 68.2 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.128 -0.487 . . . . 75.209999999999994 110.928 -179.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 17.7 tp60 -64.48 -31.72 73.05 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.145 -0.48 . . . . 74.439999999999998 110.935 179.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 26.4 t0 -72.65 -42.11 64.71 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.204 -0.453 . . . . 73.420000000000002 110.864 179.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 41.6 mtp -65.71 -57.4 8.12 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.179 -0.464 . . . . 74.329999999999998 110.907 179.963 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 62.0 mt -53.27 -45.64 55.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.216 -0.447 . . . . 71.25 111.155 179.941 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 83.0 m-20 -62.71 -29.76 70.9 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.204 -0.453 . . . . 73.420000000000002 110.891 179.915 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.36 -22.68 61.11 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.221 -0.445 . . . . 75.230000000000004 110.885 -179.983 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 35.7 m -112.96 6.28 8.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.128 -0.487 . . . . 75.319999999999993 111.176 179.963 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 30.2 t0 -86.15 97.75 10.51 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.137 -0.483 . . . . 73.420000000000002 110.891 179.923 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.28 -41.35 12.96 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.225 -0.443 . . . . 62.520000000000003 111.064 -179.993 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 57.7 p-10 -85.71 -0.13 54.32 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.197 -0.456 . . . . 74.120000000000005 110.872 -179.993 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 54.27 56.62 20.62 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.731 -0.747 . . . . 73.230000000000004 112.534 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 51.6 p-10 -114.4 -15.74 12.05 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.929 0.395 . . . . 75.120000000000005 110.914 -179.872 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 90.21 18.99 47.92 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.77 -0.729 . . . . 73.310000000000002 112.465 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 73.7 p -150.67 163.81 37.63 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.753 0.311 . . . . 74.049999999999997 111.131 -179.881 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 21.7 mt -97.96 111.05 26.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.207 -0.452 . . . . 74.230000000000004 111.122 179.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -78.43 -172.57 2.93 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.137 -0.483 . . . . 75.120000000000005 110.865 179.875 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.526 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 2.4 t80 -65.41 -57.67 14.17 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.623 0.725 . . . . 72.319999999999993 110.891 -179.926 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . 0.526 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 53.6 Cg_endo -69.78 -23.52 30.61 Favored 'Trans proline' 0 N--CA 1.465 -0.148 0 C-N-CA 122.717 2.278 . . . . 74.340000000000003 112.337 -180.0 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 15.2 mt-10 -64.45 -43.09 95.36 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.227 -0.442 . . . . 73.209999999999994 110.856 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 41.0 t80 -71.32 -36.76 71.71 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.148 -0.478 . . . . 73.299999999999997 110.866 -179.897 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 57.0 tp -70.87 -53.88 13.54 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.123 -0.49 . . . . 74.430000000000007 110.929 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 12.8 t -59.92 -26.83 66.25 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.148 -0.478 . . . . 63.329999999999998 111.159 179.935 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 10.1 tmm? -63.33 -51.15 67.19 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.201 -0.454 . . . . 70.150000000000006 110.86 179.923 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -50.89 -45.68 60.2 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.252 -0.431 . . . . 74.510000000000005 110.883 179.936 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -75.45 -28.39 59.27 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.194 -0.457 . . . . 71.540000000000006 111.113 179.929 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 31.0 ttm180 -68.53 -18.55 64.38 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.194 -0.457 . . . . 73.010000000000005 110.869 -179.902 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 23.2 pttm -50.49 -30.14 12.13 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.163 -0.472 . . . . 75.109999999999999 110.904 179.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 40.7 mtt -52.5 -28.95 22.57 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.222 -0.445 . . . . 72.409999999999997 110.909 179.841 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 20.6 pttm -142.34 -169.35 2.94 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.216 -0.447 . . . . 74.510000000000005 110.899 179.963 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 63.4 m-20 52.33 73.21 0.35 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.218 -0.446 . . . . 74.239999999999995 110.885 179.831 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 1.9 t 178.93 158.67 0.56 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.205 -0.452 . . . . 73.120000000000005 111.127 -179.889 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -173.56 -74.34 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.195 -0.457 . . . . 72.129999999999995 110.896 179.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 63.1 m -52.16 -30.02 24.85 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.206 -0.452 . . . . 75.0 110.796 -179.745 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 15.7 tp10 -71.0 -59.27 2.87 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.148 -0.478 . . . . 73.019999999999996 110.914 -179.933 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -52.67 -35.86 55.96 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.151 -0.477 . . . . 73.230000000000004 110.893 -179.993 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -62.9 -39.66 95.21 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.171 -0.468 . . . . 64.239999999999995 110.897 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 39.1 mt -74.95 -50.75 23.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.166 -0.47 . . . . 74.219999999999999 111.13 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 13.9 ttt180 -59.95 -41.72 92.47 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.17 -0.468 . . . . 72.319999999999993 110.867 179.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -52.11 -47.86 65.06 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.213 -0.449 . . . . 74.540000000000006 110.872 -179.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -74.55 -50.04 19.57 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.134 -0.485 . . . . 75.439999999999998 111.087 179.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 4.3 t80 -51.92 -34.53 42.01 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.231 -0.441 . . . . 73.430000000000007 110.838 -179.902 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -72.93 -46.01 54.89 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.156 -0.475 . . . . 73.349999999999994 110.903 -179.884 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 65.1 t -61.16 -31.01 48.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.181 -0.463 . . . . 74.5 111.156 179.922 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 21.0 m-85 -86.42 -44.07 12.32 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.156 -0.475 . . . . 74.150000000000006 110.93 179.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 44.2 t0 -67.78 87.95 0.24 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.123 -0.489 . . . . 64.310000000000002 110.866 179.979 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 2.3 tppt? -78.56 -47.16 17.79 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.212 -0.449 . . . . 72.510000000000005 110.863 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 9.5 p30 -72.65 -9.06 58.16 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.236 -0.438 . . . . 75.420000000000002 110.858 179.901 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 60.35 31.16 73.02 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.729 -0.748 . . . . 62.310000000000002 112.487 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 34.0 p-10 -81.89 -16.15 51.59 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.863 0.363 . . . . 75.230000000000004 110.879 -179.87 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 81.88 18.65 67.22 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.681 -0.771 . . . . 64.329999999999998 112.479 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 14.1 m-85 -142.49 142.93 32.36 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.852 0.358 . . . . 74.310000000000002 110.887 -179.808 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 62.3 mt -108.0 130.49 60.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.072 -0.513 . . . . 75.209999999999994 111.13 179.945 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 96.6 p -115.24 -171.76 2.01 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.201 -0.454 . . . . 71.349999999999994 110.86 -179.908 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -76.15 -40.12 53.38 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.136 -0.484 . . . . 73.329999999999998 111.079 179.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -64.16 -37.95 89.31 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.168 -0.469 . . . . 75.099999999999994 111.106 179.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 56.6 mt-10 -67.83 -50.27 57.64 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.221 -0.445 . . . . 74.299999999999997 110.885 -179.948 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 22.1 tp -55.25 -54.86 38.08 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.12 -0.491 . . . . 74.5 110.877 -179.938 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 37.0 ttp180 -52.24 -44.81 65.04 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.224 -0.443 . . . . 75.319999999999993 110.884 179.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 67.3 t60 -59.48 -34.38 72.5 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.149 -0.478 . . . . 75.230000000000004 110.892 179.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 21.7 t -74.49 -52.37 19.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.196 -0.456 . . . . 73.329999999999998 111.142 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -60.41 -41.94 94.97 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.148 -0.478 . . . . 74.450000000000003 110.901 179.896 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 11.3 p -53.51 -32.35 50.0 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.192 -0.458 . . . . 75.099999999999994 111.088 -179.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 22.6 t-20 -74.6 -29.41 61.3 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.243 -0.435 . . . . 74.420000000000002 110.876 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 2.1 mt -70.68 -24.36 62.66 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.219 -0.446 . . . . 74.439999999999998 110.905 179.944 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 101.02 32.93 5.14 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.765 -0.731 . . . . 64.030000000000001 112.531 179.924 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -112.4 114.54 27.31 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.917 0.389 . . . . 71.510000000000005 110.874 -179.832 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 3.2 ttpm? -64.61 123.35 19.07 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.158 -0.474 . . . . 75.430000000000007 110.881 179.947 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 8.5 mt -141.34 155.79 45.91 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.181 -0.463 . . . . 74.049999999999997 110.926 179.901 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 30.3 p -118.87 167.47 11.68 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.227 -0.442 . . . . 75.019999999999996 111.177 179.911 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 69.8 m-20 -51.98 -37.53 53.43 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.218 -0.447 . . . . 73.329999999999998 110.852 179.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -72.67 -34.85 67.5 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.2 -0.454 . . . . 74.439999999999998 110.881 -179.891 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -64.91 -45.87 84.1 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.178 -0.465 . . . . 61.43 110.842 -179.917 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 88.9 t -56.21 -30.65 30.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.179 -0.464 . . . . 74.209999999999994 111.153 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 54.8 t0 -66.52 -45.67 78.73 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.173 -0.467 . . . . 73.140000000000001 110.864 179.921 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -55.82 -29.48 59.86 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.213 -0.449 . . . . 72.109999999999999 110.906 -179.914 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 25.1 mtp -75.76 -59.51 2.72 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.171 -0.468 . . . . 74.530000000000001 110.896 179.935 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 34.2 mm -54.08 -35.61 29.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.243 -0.435 . . . . 73.25 111.156 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 4.9 tmm_? -66.3 -31.72 72.69 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.135 -0.484 . . . . 75.299999999999997 110.873 179.953 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -70.67 -48.22 55.93 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.231 -0.44 . . . . 74.239999999999995 110.897 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -73.12 -33.05 65.32 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.175 -0.466 . . . . 72.299999999999997 111.1 179.931 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 50.6 t0 -69.18 86.31 0.39 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.196 -0.456 . . . . 71.400000000000006 110.898 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 3.5 mt -79.95 -45.24 22.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.219 -0.446 . . . . 75.450000000000003 111.131 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 23.3 p30 -72.65 -8.9 57.6 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.188 -0.46 . . . . 74.030000000000001 110.881 179.855 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 62.94 45.36 95.82 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.747 -0.74 . . . . 52.420000000000002 112.506 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 31.6 p-10 -91.65 -16.15 27.46 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.894 0.378 . . . . 73.129999999999995 110.885 -179.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 101.94 3.8 51.7 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.73 -0.747 . . . . 64.409999999999997 112.489 -179.937 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 5.8 tt0 -149.34 172.31 15.11 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.832 0.349 . . . . 71.120000000000005 110.917 -179.882 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 136' ' ' VAL . . . . . . . . . . . . . 67.8 t -115.55 114.29 45.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.185 -0.461 . . . . 74.340000000000003 111.099 179.967 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 48.4 p-10 -94.01 -172.41 2.83 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.123 -0.489 . . . . 73.209999999999994 110.899 179.979 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 47.5 t80 -68.46 -49.26 61.15 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.185 -0.461 . . . . 74.140000000000001 110.918 -179.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -51.63 -46.68 63.73 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.172 -0.467 . . . . 75.319999999999993 110.884 179.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -70.87 -40.86 72.03 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.162 -0.472 . . . . 73.439999999999998 110.929 -179.949 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 88.0 t80 -59.68 -35.5 74.58 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.12 -0.491 . . . . 70.319999999999993 110.917 -179.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 94.2 t -64.1 -37.52 80.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.104 -0.498 . . . . 54.210000000000001 111.112 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 16.4 tm0? -70.34 -33.13 71.11 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.152 -0.477 . . . . 75.120000000000005 110.951 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 8.8 tpt -74.71 -56.31 4.93 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.225 -0.443 . . . . 75.209999999999994 110.885 179.919 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 5.0 ttm -60.54 -27.91 68.02 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.216 -0.447 . . . . 73.430000000000007 110.906 179.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 2.5 m -111.42 21.33 16.34 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.209 -0.45 . . . . 70.340000000000003 111.116 -179.924 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -51.68 114.27 1.22 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.182 -0.463 . . . . 75.040000000000006 111.112 179.819 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 8.5 mtmp? . . . . . 0 C--N 1.329 -0.325 0 CA-C-N 116.244 -0.434 . . . . 74.439999999999998 110.873 179.975 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' M' M ' 8' ' ' LEU . . . . . . . . . . . . . 26.6 mt . . . . . 0 C--O 1.231 0.1 0 CA-C-O 120.795 0.331 . . . . 74.219999999999999 110.93 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' M' M ' 9' ' ' SER . . . . . . . . . . . . . 11.2 t -57.99 116.19 3.35 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.172 -0.467 . . . . 70.310000000000002 110.862 -179.892 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' M' M ' 10' ' ' GLY . . . . . . . . . . . . . . . -130.16 35.33 2.54 Favored Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.74 -0.743 . . . . 51.549999999999997 112.453 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' M' M ' 11' ' ' GLY . . . . . . . . . . . . . . . -80.42 -112.56 0.29 Allowed Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.761 -0.733 . . . . 71.439999999999998 112.497 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' M' M ' 12' ' ' GLU . . . . . . . . . . . . . 15.1 pt-20 -95.38 179.25 5.23 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.853 0.359 . . . . 75.540000000000006 110.917 -179.873 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' M' M ' 13' ' ' LEU . . . . . . . . . . . . . 17.4 tp -53.76 106.82 0.2 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.179 -0.464 . . . . 70.530000000000001 110.956 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' M' M ' 14' ' ' ASP . . . . . . . . . . . . . 28.8 t0 -101.1 68.83 1.26 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.208 -0.451 . . . . 73.120000000000005 110.845 179.85 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' M' M ' 15' ' ' LYS . . . . . . . . . . . . . 19.2 mtmm -52.61 -46.58 67.07 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.151 -0.477 . . . . 72.209999999999994 110.894 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' M' M ' 16' ' ' TRP . . . . . . . . . . . . . 17.9 m95 -52.06 -47.21 65.23 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.251 -0.432 . . . . 71.310000000000002 110.943 179.934 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' M' M ' 17' ' ' GLU . . . . . . . . . . . . . 18.1 tt0 -57.47 -26.22 60.92 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.282 -0.417 . . . . 74.510000000000005 110.892 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' M' M ' 18' ' ' LYS . . . . . . . . . . . . . 6.0 ttpm? -73.06 -25.8 61.05 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.11 -0.496 . . . . 73.319999999999993 110.885 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' M' M ' 19' ' ' ILE . . . . . . . . . . . . . 28.7 mt -76.64 -21.79 14.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.253 -0.431 . . . . 72.099999999999994 111.116 179.896 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' M' M ' 20' ' ' ARG . . . . . . . . . . . . . 43.1 ttt180 -51.69 -39.82 58.97 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.187 -0.46 . . . . 75.099999999999994 110.859 179.931 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' M' M ' 21' ' ' LEU . . . . . . . . . . . . . 4.5 mt 53.57 -172.26 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.176 -0.465 . . . . 74.140000000000001 110.948 -179.901 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' M' M ' 22' ' ' ARG . . . . . . . . . . . . . 49.7 ttm-85 -106.45 136.83 19.33 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.558 0.694 . . . . 70.450000000000003 110.895 179.963 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' M' M ' 23' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.78 163.63 37.56 Favored 'Trans proline' 0 C--N 1.341 0.149 0 C-N-CA 122.704 2.269 . . . . 75.530000000000001 112.308 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' M' M ' 24' ' ' GLY . . . . . . . . . . . . . . . -141.86 -85.93 0.09 OUTLIER Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.742 -0.742 . . . . 73.310000000000002 112.54 179.948 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' M' M ' 25' ' ' GLY . . . . . . . . . . . . . . . -77.12 148.73 34.9 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.751 -0.738 . . . . 71.040000000000006 112.483 -179.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' M' M ' 26' ' ' LYS . . . . . . . . . . . . . 15.4 mmtp -136.29 65.72 1.51 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.845 0.355 . . . . 74.349999999999994 110.907 -179.924 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' M' M ' 27' ' ' LYS . . . . . . . . . . . . . 14.9 mtpp -147.03 78.63 1.49 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.265 -0.425 . . . . 75.310000000000002 110.893 179.868 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' M' M ' 28' ' ' GLN . . . . . . . . . . . . . 36.4 tp60 -178.41 120.98 0.09 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.248 -0.433 . . . . 74.519999999999996 110.93 179.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' M' M ' 29' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -67.77 -177.44 0.79 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.189 -0.46 . . . . 75.430000000000007 110.933 -179.873 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' M' M ' 30' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -124.06 27.4 7.17 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.108 -0.496 . . . . 74.329999999999998 110.878 179.908 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' M' M ' 31' ' ' LEU . . . . . . . . . . . . . 12.3 tp -136.73 -41.25 0.61 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.226 -0.443 . . . . 62.100000000000001 110.924 179.886 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' M' M ' 32' ' ' LYS . . . . . . . . . . . . . 12.2 ptmm? -47.13 -42.15 18.79 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.247 -0.433 . . . . 75.340000000000003 110.911 179.791 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' M' M ' 33' ' ' HIS . . . . . . . . . . . . . 19.4 t60 -49.12 -44.4 42.33 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.218 -0.446 . . . . 75.209999999999994 110.843 179.871 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' M' M ' 34' ' ' ILE . . . . . . . . . . . . . 77.7 mt -51.54 -38.34 20.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.199 -0.455 . . . . 73.140000000000001 111.168 179.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' M' M ' 35' ' ' VAL . . . . . . . . . . . . . 38.1 t -50.14 -39.17 15.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.195 -0.457 . . . . 73.519999999999996 111.08 179.872 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' M' M ' 36' ' ' TRP . . . . . . . . . . . . . 22.5 m0 -59.06 -39.13 81.11 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.182 -0.463 . . . . 75.219999999999999 110.907 179.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' M' M ' 37' ' ' ALA . . . . . . . . . . . . . . . -64.22 -18.52 64.59 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.222 -0.445 . . . . 74.420000000000002 111.099 179.939 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' M' M ' 38' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -73.13 -17.87 61.35 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.215 -0.448 . . . . 70.010000000000005 110.817 -179.744 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' M' M ' 39' ' ' ARG . . . . . . . . . . . . . 1.4 tpt180 -58.68 -25.6 63.0 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.165 -0.47 . . . . 74.510000000000005 110.897 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' M' M ' 40' ' ' GLU . . . . . . . . . . . . . 2.4 pt-20 -87.07 -27.89 22.88 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.142 -0.481 . . . . 72.230000000000004 110.894 -179.939 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' M' M ' 41' ' ' LEU . . . . . . . . . . . . . 11.3 mt -82.21 131.14 35.23 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.147 -0.478 . . . . 73.219999999999999 110.923 179.993 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' M' M ' 42' ' ' GLU . . . . . . . . . . . . . 75.4 tt0 -168.34 142.64 3.34 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.166 -0.47 . . . . 74.420000000000002 110.836 179.92 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' M' M ' 43' ' ' ARG . . . . . . . . . . . . . 19.8 ptt180 . . . . . 0 C--N 1.33 -0.278 0 CA-C-N 116.11 -0.496 . . . . 74.120000000000005 110.905 -179.962 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 241' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 262' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 301' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 322' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.1 0 CA-C-O 120.826 0.346 . . . . 71.439999999999998 111.074 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 19.8 m-20 -134.27 139.4 45.7 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.207 -0.451 . . . . 75.439999999999998 110.832 -179.97 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 14.5 pt20 -138.36 169.85 17.07 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.181 -0.463 . . . . 64.099999999999994 110.895 -179.897 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -84.83 109.31 18.01 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.18 -0.463 . . . . 74.420000000000002 110.904 179.995 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 27.4 p -111.07 171.69 7.32 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.204 -0.453 . . . . 73.109999999999999 111.146 179.914 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 9.7 tt0 -52.17 -45.22 65.02 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.219 -0.446 . . . . 74.439999999999998 110.884 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -61.39 -26.77 68.07 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.135 -0.484 . . . . 73.200000000000003 110.9 -179.91 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 24.6 tt0 -77.92 -57.46 3.79 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.162 -0.472 . . . . 74.420000000000002 110.904 -179.968 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 3.2 mp -62.66 -52.33 61.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.235 -0.439 . . . . 75.219999999999999 111.077 -179.976 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -52.0 -33.76 39.74 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.187 -0.461 . . . . 74.450000000000003 111.114 179.8 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -74.9 -51.66 13.28 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.192 -0.458 . . . . 72.209999999999994 110.864 -179.897 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 16.5 m-85 -58.2 -42.22 85.69 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.17 -0.468 . . . . 71.340000000000003 110.891 -179.899 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -51.91 -37.85 54.04 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.131 -0.486 . . . . 72.409999999999997 110.892 179.986 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 -66.13 -35.83 81.52 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.252 -0.431 . . . . 64.209999999999994 110.831 179.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -65.63 -41.06 93.08 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.164 -0.471 . . . . 73.140000000000001 111.078 179.943 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 85.3 t80 -53.4 -51.58 62.1 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.253 -0.43 . . . . 72.439999999999998 110.881 -179.927 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 14.7 p -53.23 -32.71 49.63 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.176 -0.465 . . . . 72.319999999999993 110.857 -179.824 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 17.5 tp -64.58 -38.92 92.68 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.141 -0.481 . . . . 74.25 110.879 -179.991 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 48.1 m-85 -82.04 -27.65 32.92 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.233 -0.44 . . . . 75.120000000000005 110.888 179.966 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -82.83 98.56 9.21 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.164 -0.471 . . . . 72.120000000000005 110.835 179.962 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 40.4 mmtt -69.91 -54.14 14.73 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.197 -0.456 . . . . 73.349999999999994 110.878 179.969 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 22.3 p-10 -77.2 -10.12 59.21 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.215 -0.448 . . . . 72.409999999999997 110.879 179.879 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 52.02 42.26 54.07 Favored Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.726 -0.75 . . . . 73.409999999999997 112.453 -179.959 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 29.9 p-10 -88.57 -15.66 34.53 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.872 0.367 . . . . 71.109999999999999 110.882 -179.998 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 105.4 -11.74 47.36 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.723 -0.751 . . . . 74.120000000000005 112.463 -179.965 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 34.0 p -125.8 130.78 52.1 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.723 0.297 . . . . 65.219999999999999 111.168 -179.818 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 25.0 mt -98.58 125.98 51.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.241 -0.436 . . . . 74.439999999999998 111.108 179.969 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 73.9 p -111.41 -178.51 3.47 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.188 -0.46 . . . . 72.310000000000002 111.1 -179.998 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 2.0 p -66.57 -26.76 67.27 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.214 -0.448 . . . . 75.120000000000005 111.147 -179.966 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 2.2 tppp? -75.07 -50.19 17.25 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.224 -0.444 . . . . 75.329999999999998 110.883 179.878 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 28.4 mt-10 -71.32 -40.38 70.8 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.266 -0.425 . . . . 74.150000000000006 110.843 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 3.9 tt -74.07 -49.19 25.18 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.199 -0.455 . . . . 74.109999999999999 110.921 -179.988 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -54.25 -27.94 41.13 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.771 -0.728 . . . . 73.010000000000005 112.453 179.93 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 95.1 m -68.97 -53.47 20.53 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.827 0.346 . . . . 75.140000000000001 111.095 -179.828 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 39.2 t -51.76 -51.42 27.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.223 -0.444 . . . . 73.349999999999994 111.172 179.89 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 7.5 mtt -54.21 -49.14 70.09 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.126 -0.488 . . . . 73.329999999999998 110.859 179.94 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 2.6 tmt_? -59.1 -42.6 90.87 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.205 -0.452 . . . . 72.109999999999999 110.887 -179.929 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 4.2 t -57.5 -29.9 64.68 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.14 -0.482 . . . . 72.409999999999997 110.859 -179.785 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 9.3 mt -91.91 -4.38 54.78 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.13 -0.486 . . . . 74.109999999999999 110.957 179.988 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 101.42 -13.15 58.4 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.738 -0.744 . . . . 73.150000000000006 112.523 179.943 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -81.48 96.27 7.35 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.855 0.359 . . . . 71.420000000000002 110.917 -179.883 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 6.4 t-20 -109.74 82.67 2.4 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.672 0.749 . . . . 75.019999999999996 110.874 -179.952 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.8 168.05 22.72 Favored 'Trans proline' 0 C--N 1.342 0.187 0 C-N-CA 122.719 2.279 . . . . 75.140000000000001 112.332 179.949 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 20.0 p -83.98 158.35 21.55 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.224 -0.443 . . . . 72.349999999999994 111.128 -179.947 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 15.1 mp0 -51.97 -48.36 64.38 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.228 -0.442 . . . . 71.040000000000006 110.914 179.98 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.78 -31.55 72.59 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.159 -0.473 . . . . 63.409999999999997 111.062 179.967 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -68.28 -52.0 38.73 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.259 -0.428 . . . . 74.439999999999998 110.915 -179.908 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 25.3 mt -55.09 -48.67 73.24 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.122 -0.49 . . . . 72.129999999999995 110.904 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 17.5 tp60 -54.4 -29.43 48.93 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.212 -0.449 . . . . 64.5 110.91 179.932 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 46.1 t0 -74.49 -29.53 61.46 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.189 -0.46 . . . . 73.420000000000002 110.862 179.989 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 41.5 mtp -73.14 -58.06 3.58 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.174 -0.467 . . . . 70.340000000000003 110.857 -179.974 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 62.0 mt -53.32 -52.75 28.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.22 -0.446 . . . . 72.200000000000003 111.105 179.981 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 78.4 m-20 -57.0 -25.28 58.21 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.236 -0.438 . . . . 71.519999999999996 110.894 179.967 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -75.54 -28.33 59.02 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.145 -0.48 . . . . 64.25 110.87 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 9.8 m -109.81 10.87 8.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.164 -0.471 . . . . 60.530000000000001 111.104 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 28.8 t0 -86.69 99.99 12.15 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.199 -0.455 . . . . 62.039999999999999 110.869 179.89 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.3 -46.87 8.85 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.163 -0.471 . . . . 70.349999999999994 111.126 179.911 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 50.7 p30 -81.63 -0.3 41.84 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.226 -0.443 . . . . 72.340000000000003 110.88 -179.998 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 55.26 55.47 28.19 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.734 -0.746 . . . . 53.340000000000003 112.517 -179.916 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 50.3 p-10 -114.55 -15.76 11.97 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.863 0.363 . . . . 73.420000000000002 110.872 -179.858 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 89.39 20.46 44.98 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.705 -0.76 . . . . 64.329999999999998 112.527 -179.981 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 71.4 p -150.49 161.1 43.18 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.723 0.296 . . . . 73.530000000000001 111.117 -179.814 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 22.9 mt -98.98 114.59 37.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.214 -0.448 . . . . 75.310000000000002 111.151 179.882 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.4 t0 -82.33 -172.84 4.22 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.213 -0.449 . . . . 74.439999999999998 110.86 179.902 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.519 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 2.4 t80 -65.1 -58.21 13.23 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.65 0.738 . . . . 72.409999999999997 110.867 -179.89 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . 0.519 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 53.9 Cg_endo -69.74 -24.26 29.98 Favored 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.674 2.25 . . . . 64.510000000000005 112.315 -179.968 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 75.9 mt-10 -65.29 -41.78 93.8 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.254 -0.43 . . . . 75.310000000000002 110.917 -179.964 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 26.5 t80 -72.54 -36.11 68.19 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.148 -0.478 . . . . 63.520000000000003 110.863 -179.932 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 50.2 tp -68.98 -53.67 19.39 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.137 -0.483 . . . . 74.349999999999994 110.901 -179.973 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 13.3 t -58.44 -26.67 63.58 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.242 -0.436 . . . . 74.209999999999994 111.137 179.936 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 5.3 tmm? -62.25 -50.41 71.84 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.243 -0.435 . . . . 75.349999999999994 110.868 179.94 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 1.2 mmt -51.61 -45.39 63.2 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.215 -0.448 . . . . 74.219999999999999 110.88 179.951 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -75.03 -28.58 60.53 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.238 -0.437 . . . . 62.210000000000001 111.1 179.967 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 19.5 tpp180 -67.48 -18.0 64.9 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.18 -0.464 . . . . 73.209999999999994 110.891 -179.929 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 8.4 pttp -50.41 -29.62 10.58 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.168 -0.469 . . . . 74.109999999999999 110.886 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 88.4 mmm -51.45 -29.88 17.69 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.212 -0.449 . . . . 74.430000000000007 110.854 179.881 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 7.9 ptpt -178.94 111.89 0.06 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.251 -0.431 . . . . 63.140000000000001 110.891 179.922 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 10.8 t70 -144.7 -68.62 0.31 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.241 -0.436 . . . . 73.099999999999994 110.858 179.883 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 1.7 m -121.15 137.7 54.55 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.204 -0.453 . . . . 63.32 111.146 -179.883 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -112.2 -35.66 5.56 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.217 -0.447 . . . . 42.240000000000002 110.854 179.929 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 1.1 m -54.4 -33.6 59.6 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.227 -0.442 . . . . 72.329999999999998 110.852 -179.763 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 11.1 tp10 -60.98 -52.74 63.74 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.155 -0.475 . . . . 73.409999999999997 110.933 -179.979 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -53.18 -37.24 61.74 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.144 -0.48 . . . . 74.010000000000005 110.858 -179.919 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 15.8 tt0 -60.92 -33.57 73.35 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.147 -0.479 . . . . 65.349999999999994 110.873 -179.916 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 61.9 mt -70.23 -44.86 77.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.156 -0.475 . . . . 72.230000000000004 111.142 179.961 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 53.6 ttp180 -72.02 -32.92 67.63 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.193 -0.458 . . . . 75.019999999999996 110.871 179.975 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 24.9 mm-40 -76.56 -48.29 19.78 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.165 -0.471 . . . . 74.409999999999997 110.939 -179.975 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -53.37 -43.01 67.44 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.182 -0.463 . . . . 74.340000000000003 111.122 179.883 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 36.0 t80 -52.01 -37.28 52.76 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.244 -0.434 . . . . 74.109999999999999 110.875 -179.937 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 3.4 tmt_? -71.0 -38.67 72.66 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.128 -0.487 . . . . 74.329999999999998 110.845 -179.888 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 31.5 t -62.21 -48.13 89.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.196 -0.456 . . . . 75.420000000000002 111.13 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 9.9 m-85 -68.3 -26.3 65.57 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.186 -0.461 . . . . 73.150000000000006 110.875 -179.987 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 37.6 t0 -72.84 92.81 1.63 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.151 -0.477 . . . . 75.409999999999997 110.873 179.948 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 34.4 ttmt -78.57 -51.02 10.53 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.192 -0.458 . . . . 74.239999999999995 110.882 179.985 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 24.0 p30 -72.44 -9.1 58.11 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.228 -0.442 . . . . 61.329999999999998 110.866 179.87 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 60.0 29.37 67.86 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.779 -0.724 . . . . 70.120000000000005 112.482 -179.951 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 42.6 p-10 -82.98 -16.15 48.37 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.91 0.386 . . . . 73.430000000000007 110.908 -179.884 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 93.66 18.7 37.13 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.709 -0.757 . . . . 74.209999999999994 112.469 179.965 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 21.8 m-85 -139.26 165.56 26.86 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.884 0.373 . . . . 74.299999999999997 110.909 -179.799 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 77.5 mt -122.37 114.56 43.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.135 -0.484 . . . . 63.409999999999997 111.126 179.91 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 4.9 p -102.52 174.93 5.68 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.174 -0.466 . . . . 72.530000000000001 110.906 -179.927 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -67.73 -30.2 69.62 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.191 -0.459 . . . . 61.009999999999998 111.124 179.889 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -68.13 -43.91 77.27 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.17 -0.468 . . . . 73.109999999999999 111.15 179.912 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 91.0 mt-10 -74.13 -47.68 34.52 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.193 -0.458 . . . . 71.439999999999998 110.875 -179.934 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 34.8 tp -53.86 -49.78 67.72 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.159 -0.473 . . . . 73.209999999999994 110.916 -179.944 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 26.3 ttt180 -52.25 -41.62 62.96 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.191 -0.458 . . . . 75.439999999999998 110.876 179.923 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 27.3 t60 -59.74 -34.47 72.99 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.232 -0.44 . . . . 75.209999999999994 110.903 179.984 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 38.3 t -66.86 -45.71 86.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.193 -0.458 . . . . 73.230000000000004 111.153 179.956 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 3.4 mmt -60.59 -37.0 79.91 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.186 -0.461 . . . . 71.430000000000007 110.85 179.939 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 2.1 m -55.03 -34.33 63.41 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.236 -0.438 . . . . 71.040000000000006 111.152 -179.948 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 4.9 t-20 -70.96 -30.69 67.05 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.22 -0.446 . . . . 73.409999999999997 110.87 179.974 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 18.1 mt -73.01 -26.28 61.27 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.189 -0.46 . . . . 71.439999999999998 110.918 179.967 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 99.9 30.13 6.56 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.767 -0.73 . . . . 73.439999999999998 112.465 179.874 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -115.14 112.69 22.94 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.915 0.388 . . . . 63.009999999999998 110.87 -179.876 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.57 119.77 12.28 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.127 -0.488 . . . . 62.219999999999999 110.87 179.951 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 7.8 mt -140.49 155.82 46.54 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.215 -0.448 . . . . 74.450000000000003 110.891 179.883 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 52.5 p -115.03 170.54 8.27 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.181 -0.463 . . . . 74.109999999999999 111.141 179.958 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 20.6 m-20 -58.71 -33.21 69.94 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.215 -0.448 . . . . 75.409999999999997 110.857 179.909 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 22.5 tp10 -75.68 -33.46 60.39 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.184 -0.462 . . . . 74.519999999999996 110.865 -179.882 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 13.7 tt0 -71.15 -31.77 68.12 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.171 -0.468 . . . . 75.150000000000006 110.856 -179.914 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 43.5 t -71.27 -31.96 45.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.187 -0.461 . . . . 73.049999999999997 111.153 179.963 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 12.2 t0 -51.98 -46.86 65.02 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.137 -0.483 . . . . 71.120000000000005 110.811 179.954 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 20.6 tp10 -55.82 -29.33 59.6 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.214 -0.448 . . . . 73.310000000000002 110.877 -179.859 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 71.7 mtp -75.55 -59.48 2.73 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.144 -0.48 . . . . 73.540000000000006 110.903 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 35.9 mm -53.93 -35.7 28.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.243 -0.435 . . . . 71.209999999999994 111.165 179.898 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 56.8 ttt180 -63.49 -31.85 73.13 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.152 -0.476 . . . . 73.129999999999995 110.915 179.932 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -74.66 -52.37 11.83 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.139 -0.482 . . . . 74.329999999999998 110.864 -179.892 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -65.23 -34.49 78.48 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.102 -0.499 . . . . 74.239999999999995 111.099 179.925 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 49.4 t0 -68.45 86.74 0.3 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.26 -0.427 . . . . 74.540000000000006 110.864 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 55.2 mt -79.83 -46.13 22.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.166 -0.47 . . . . 72.140000000000001 111.141 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 21.3 p30 -72.8 -8.74 56.94 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.181 -0.463 . . . . 73.340000000000003 110.875 179.864 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 62.76 42.59 99.66 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.703 -0.761 . . . . 74.129999999999995 112.476 -179.917 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 34.6 p-10 -87.58 -16.0 35.8 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.864 0.364 . . . . 71.340000000000003 110.919 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 104.12 2.37 45.11 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.745 -0.741 . . . . 74.439999999999998 112.431 -179.988 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 4.0 tt0 -149.16 172.27 15.09 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.901 0.382 . . . . 73.409999999999997 110.894 -179.921 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 136' ' ' VAL . . . . . . . . . . . . . 99.3 t -107.33 111.25 34.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.21 -0.45 . . . . 75.430000000000007 111.127 179.98 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 19.0 p30 -92.11 165.59 13.08 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.15 -0.477 . . . . 74.150000000000006 110.881 -179.993 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 37.0 t80 -52.01 -46.89 65.15 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.162 -0.472 . . . . 75.310000000000002 110.983 -179.919 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 15.3 tt0 -51.94 -42.14 62.6 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.077 -0.51 . . . . 65.340000000000003 110.943 179.965 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 23.7 mt-10 -76.52 -34.27 58.58 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.108 -0.497 . . . . 71.409999999999997 110.92 -179.951 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 43.2 t80 -65.74 -38.93 90.48 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.121 -0.49 . . . . 74.150000000000006 110.855 -179.897 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 98.9 t -71.34 -40.6 73.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.121 -0.491 . . . . 64.299999999999997 111.123 -179.989 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 24.4 tt0 -70.83 -45.31 64.78 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.173 -0.467 . . . . 65.230000000000004 110.911 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 11.4 tpt -65.0 -26.2 68.19 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.172 -0.467 . . . . 73.049999999999997 110.87 180.0 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 6.4 ttm -87.61 -39.47 15.04 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.25 -0.432 . . . . 74.209999999999994 110.887 179.916 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 2.6 m -96.6 21.31 9.5 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.197 -0.456 . . . . 72.430000000000007 111.113 -179.87 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -51.7 143.36 12.91 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.235 -0.438 . . . . 64.150000000000006 111.118 179.807 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 18.9 tptm . . . . . 0 C--N 1.329 -0.295 0 CA-C-N 116.234 -0.439 . . . . 71.310000000000002 110.949 179.935 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' M' M ' 8' ' ' LEU . . . . . . . . . . . . . 19.7 tp . . . . . 0 C--O 1.231 0.086 0 CA-C-O 120.821 0.343 . . . . 65.099999999999994 110.9 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' M' M ' 9' ' ' SER . . . . . . . . . . . . . 6.2 t 53.44 87.0 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.138 -0.483 . . . . 73.099999999999994 110.868 -179.945 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' M' M ' 10' ' ' GLY . . . . . . . . . . . . . . . -82.18 -113.16 0.43 Allowed Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.783 -0.722 . . . . 73.25 112.45 -179.964 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' M' M ' 11' ' ' GLY . . . . . . . . . . . . . . . 106.34 -30.65 9.25 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.688 -0.768 . . . . 73.299999999999997 112.484 -179.891 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' M' M ' 12' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -111.53 -179.12 3.62 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.895 0.378 . . . . 74.230000000000004 110.882 -179.852 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' M' M ' 13' ' ' LEU . . . . . . . . . . . . . 28.8 tp -63.88 136.33 57.29 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.179 -0.464 . . . . 75.140000000000001 110.889 -179.937 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' M' M ' 14' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -84.02 -27.81 28.11 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.192 -0.458 . . . . 73.319999999999993 110.878 179.829 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' M' M ' 15' ' ' LYS . . . . . . . . . . . . . 44.7 mttp -60.16 -56.88 16.12 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.212 -0.449 . . . . 71.209999999999994 110.888 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' M' M ' 16' ' ' TRP . . . . . . . . . . . . . 10.2 m95 -54.09 -39.03 65.96 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.241 -0.436 . . . . 74.299999999999997 110.919 179.923 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' M' M ' 17' ' ' GLU . . . . . . . . . . . . . 15.3 tm-20 -56.9 -27.8 61.15 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.227 -0.442 . . . . 74.420000000000002 110.872 -179.929 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' M' M ' 18' ' ' LYS . . . . . . . . . . . . . 6.9 ttpm? -73.45 -26.95 61.16 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.153 -0.476 . . . . 75.420000000000002 110.913 179.953 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' M' M ' 19' ' ' ILE . . . . . . . . . . . . . 27.6 mt -93.02 -23.45 5.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.25 -0.432 . . . . 71.140000000000001 111.169 179.848 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' M' M ' 20' ' ' ARG . . . . . . . . . . . . . 25.5 ttp85 -52.07 -38.35 56.86 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.193 -0.458 . . . . 74.340000000000003 110.846 179.972 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' M' M ' 21' ' ' LEU . . . . . . . . . . . . . 6.1 mt 58.95 176.65 0.07 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.231 -0.44 . . . . 74.310000000000002 110.951 -179.979 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' M' M ' 22' ' ' ARG . . . . . . . . . . . . . 16.7 ttt180 -175.94 64.91 0.23 Allowed Pre-proline 0 C--N 1.328 -0.329 0 CA-C-O 121.672 0.748 . . . . 73.0 110.9 179.942 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' M' M ' 23' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.74 -48.38 0.74 Allowed 'Trans proline' 0 C--N 1.342 0.187 0 C-N-CA 122.753 2.302 . . . . 75.540000000000006 112.314 -179.987 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' M' M ' 24' ' ' GLY . . . . . . . . . . . . . . . 59.73 96.36 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.748 -0.739 . . . . 73.129999999999995 112.449 -179.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' M' M ' 25' ' ' GLY . . . . . . . . . . . . . . . -157.39 -148.65 5.18 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.743 -0.741 . . . . 71.530000000000001 112.512 -179.948 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' M' M ' 26' ' ' LYS . . . . . . . . . . . . . 3.0 mtpm? -137.34 136.95 38.41 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.901 0.381 . . . . 74.420000000000002 110.908 179.981 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' M' M ' 27' ' ' LYS . . . . . . . . . . . . . 4.6 ttmm -156.91 -72.71 0.1 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.196 -0.456 . . . . 65.519999999999996 110.888 179.924 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' M' M ' 28' ' ' GLN . . . . . . . . . . . . . 2.4 mm100 -147.57 179.66 7.52 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.243 -0.435 . . . . 75.129999999999995 110.889 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' M' M ' 29' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -104.05 -177.34 3.34 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.191 -0.459 . . . . 64.329999999999998 110.907 -179.835 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' M' M ' 30' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -147.46 49.87 1.08 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.116 -0.493 . . . . 74.140000000000001 110.896 179.908 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' M' M ' 31' ' ' LEU . . . . . . . . . . . . . 10.9 tp -147.95 -46.56 0.16 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.253 -0.431 . . . . 70.409999999999997 110.898 179.984 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' M' M ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.45 -32.83 8.31 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.169 -0.469 . . . . 75.109999999999999 110.919 179.866 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' M' M ' 33' ' ' HIS . . . . . . . . . . . . . 77.6 t60 -47.99 -47.17 33.23 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.226 -0.443 . . . . 72.409999999999997 110.846 179.919 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' M' M ' 34' ' ' ILE . . . . . . . . . . . . . 3.6 mp -51.73 -38.75 22.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.169 -0.469 . . . . 75.310000000000002 111.137 179.967 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' M' M ' 35' ' ' VAL . . . . . . . . . . . . . 47.1 t -49.01 -39.63 12.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.203 -0.453 . . . . 74.200000000000003 111.138 179.826 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' M' M ' 36' ' ' TRP . . . . . . . . . . . . . 20.9 m0 -59.19 -40.21 85.03 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.197 -0.456 . . . . 73.310000000000002 110.923 179.972 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' M' M ' 37' ' ' ALA . . . . . . . . . . . . . . . -63.01 -18.77 63.68 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.231 -0.44 . . . . 73.019999999999996 111.09 179.912 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' M' M ' 38' ' ' SER . . . . . . . . . . . . . 5.0 m -64.92 -17.8 64.66 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.207 -0.451 . . . . 64.129999999999995 110.886 -179.803 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' M' M ' 39' ' ' ARG . . . . . . . . . . . . . 52.3 mtp180 -52.12 -29.2 20.77 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.123 -0.49 . . . . 74.430000000000007 110.88 -179.931 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' M' M ' 40' ' ' GLU . . . . . . . . . . . . . 17.7 tp10 -90.05 -48.08 7.42 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.205 -0.452 . . . . 71.299999999999997 110.887 -179.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' M' M ' 41' ' ' LEU . . . . . . . . . . . . . 6.8 mt -56.56 132.36 51.38 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.132 -0.485 . . . . 74.299999999999997 110.9 -179.958 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' M' M ' 42' ' ' GLU . . . . . . . . . . . . . 69.3 mt-10 -134.6 60.43 1.7 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.224 -0.444 . . . . 75.030000000000001 110.909 179.864 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' M' M ' 43' ' ' ARG . . . . . . . . . . . . . 26.8 mmt85 . . . . . 0 C--N 1.329 -0.319 0 CA-C-N 116.171 -0.468 . . . . 75.430000000000007 110.868 -179.917 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 241' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 262' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 301' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 322' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.457 -0.107 0 CA-C-O 120.793 0.33 . . . . 61.329999999999998 111.09 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -161.36 178.34 9.28 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.207 -0.451 . . . . 74.340000000000003 110.876 179.923 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 2.5 tp-100 58.29 94.05 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.181 -0.463 . . . . 75.219999999999999 110.906 -179.889 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -65.35 109.38 2.25 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.163 -0.471 . . . . 73.420000000000002 110.936 -180.0 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 77.6 p -94.11 175.86 6.54 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.201 -0.454 . . . . 74.420000000000002 111.166 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 22.8 tt0 -60.28 -38.69 84.35 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.209 -0.451 . . . . 62.119999999999997 110.875 -179.975 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 28.0 tt0 -68.51 -33.27 73.85 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.129 -0.487 . . . . 72.5 110.842 -179.89 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 32.4 tt0 -78.03 -41.2 36.48 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.161 -0.472 . . . . 74.030000000000001 110.921 -179.904 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 54.3 mt -72.69 -45.8 56.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.184 -0.462 . . . . 73.239999999999995 111.105 179.962 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -52.0 -29.54 21.26 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.23 -0.441 . . . . 74.040000000000006 111.087 179.818 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 41.3 tp10 -73.87 -38.39 64.45 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.263 -0.426 . . . . 74.420000000000002 110.93 -179.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 30.3 m-85 -75.82 -46.02 32.76 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.108 -0.496 . . . . 74.530000000000001 110.854 -179.933 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 35.1 ttmt -60.63 -35.47 76.26 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.175 -0.466 . . . . 72.310000000000002 110.955 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 23.0 mt-10 -58.62 -37.73 76.51 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.228 -0.442 . . . . 75.400000000000006 110.911 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -71.43 -43.94 65.79 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.126 -0.488 . . . . 73.140000000000001 111.096 179.913 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 92.6 t80 -55.49 -53.97 49.76 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.254 -0.43 . . . . 74.439999999999998 110.868 -179.912 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 12.6 t -52.43 -30.41 29.34 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.177 -0.465 . . . . 74.040000000000006 110.887 -179.799 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 15.6 tp -65.71 -42.19 91.43 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.099 -0.5 . . . . 75.230000000000004 110.878 -179.968 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 43.1 m-85 -75.43 -25.46 57.51 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.181 -0.463 . . . . 74.040000000000006 110.866 179.948 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 20.9 t0 -84.02 98.54 9.89 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.167 -0.469 . . . . 64.140000000000001 110.85 179.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 15.7 ttmm -71.11 -55.51 8.04 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.167 -0.47 . . . . 73.349999999999994 110.906 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 22.5 p-10 -72.19 -10.15 59.4 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.225 -0.443 . . . . 74.120000000000005 110.833 179.909 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 51.82 42.14 52.53 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.777 -0.725 . . . . 74.510000000000005 112.506 -179.9 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 27.5 p-10 -88.44 -15.8 34.48 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.824 0.345 . . . . 73.340000000000003 110.814 -179.967 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 104.98 -7.14 44.17 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.776 -0.726 . . . . 74.439999999999998 112.496 -179.907 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 2.8 p -131.79 130.83 42.34 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.737 0.304 . . . . 75.319999999999993 111.168 -179.862 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 28.7 mt -93.69 120.32 42.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.191 -0.459 . . . . 73.510000000000005 111.143 179.91 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 20.3 p -101.43 175.46 5.56 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.164 -0.471 . . . . 74.540000000000006 111.146 179.948 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 33.7 p -62.36 -24.97 67.66 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.185 -0.461 . . . . 74.400000000000006 111.146 -179.97 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 31.3 mttm -73.09 -50.1 24.78 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.215 -0.448 . . . . 72.549999999999997 110.898 179.901 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -73.74 -32.69 63.98 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.255 -0.43 . . . . 74.530000000000001 110.883 179.975 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -73.51 -40.87 63.71 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.16 -0.473 . . . . 73.540000000000006 110.919 179.99 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -71.73 -40.52 58.3 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.736 -0.745 . . . . 74.430000000000007 112.51 179.923 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 96.7 m -59.6 -56.09 26.24 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.825 0.345 . . . . 75.120000000000005 111.107 -179.852 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 97.4 t -51.44 -50.11 29.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.247 -0.433 . . . . 73.219999999999999 111.139 179.908 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 3.0 mtp -52.07 -32.1 33.22 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.125 -0.489 . . . . 74.299999999999997 110.901 179.918 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 40.8 ttt-85 -64.4 -48.23 76.19 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.207 -0.451 . . . . 72.150000000000006 110.868 -179.919 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 2.2 p -59.42 -28.81 67.27 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.176 -0.466 . . . . 71.230000000000004 110.834 -179.775 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 32.8 mt -80.32 -16.27 54.98 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.183 -0.462 . . . . 73.239999999999995 110.928 179.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 101.58 27.11 7.31 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.721 -0.752 . . . . 71.409999999999997 112.487 179.927 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 5.2 mt-30 -119.69 135.42 54.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.802 0.334 . . . . 74.0 110.894 -179.845 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 32.5 t-20 -109.79 76.76 0.97 Allowed Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 121.627 0.727 . . . . 71.209999999999994 110.914 -179.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.75 149.73 67.35 Favored 'Trans proline' 0 C--O 1.232 0.191 0 C-N-CA 122.634 2.223 . . . . 63.409999999999997 112.375 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 20.9 p -99.15 176.77 5.43 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.23 -0.441 . . . . 74.540000000000006 111.109 -179.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 36.1 mm-40 -64.83 -47.02 79.47 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.185 -0.461 . . . . 74.439999999999998 110.949 179.94 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.4 -38.94 65.43 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.158 -0.474 . . . . 73.430000000000007 111.047 179.94 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 13.2 tt0 -55.8 -52.65 63.24 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.267 -0.424 . . . . 75.219999999999999 110.896 -179.916 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 9.2 mt -57.59 -52.19 66.43 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.15 -0.477 . . . . 73.099999999999994 110.948 179.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.2 mm-40 -56.97 -28.5 62.36 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.21 -0.45 . . . . 72.530000000000001 110.88 179.933 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -63.98 -49.57 71.97 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.199 -0.455 . . . . 73.239999999999995 110.881 179.998 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 6.7 ptp -75.71 -37.49 59.4 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.233 -0.439 . . . . 74.409999999999997 110.878 179.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 79.2 mt -65.31 -47.49 86.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.23 -0.441 . . . . 75.430000000000007 111.138 179.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 85.2 m-20 -58.39 -33.58 69.78 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.147 -0.479 . . . . 73.340000000000003 110.895 179.921 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 15.0 mm-40 -62.41 -51.02 69.2 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.178 -0.464 . . . . 74.319999999999993 110.901 -179.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 17.6 m -77.98 -15.0 14.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.125 -0.489 . . . . 74.230000000000004 111.143 179.97 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 39.1 t0 -66.75 95.19 0.34 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.172 -0.467 . . . . 64.530000000000001 110.89 179.877 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.26 -35.3 17.36 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.166 -0.47 . . . . 73.430000000000007 111.101 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -88.22 -0.13 56.76 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.199 -0.455 . . . . 75.010000000000005 110.852 -179.998 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 52.79 58.95 9.99 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.726 -0.749 . . . . 50.539999999999999 112.495 -179.954 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 51.8 p-10 -114.63 -15.78 11.92 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.836 0.351 . . . . 75.129999999999995 110.888 -179.899 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 93.25 18.54 38.91 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.755 -0.736 . . . . 74.299999999999997 112.471 179.961 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 63.9 p -150.76 170.77 18.44 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.754 0.312 . . . . 75.219999999999999 111.153 -179.855 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 21.5 mt -102.47 109.53 26.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.257 -0.429 . . . . 74.310000000000002 111.132 179.942 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -74.13 -172.86 1.48 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.18 -0.464 . . . . 73.299999999999997 110.869 179.866 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.526 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 2.5 t80 -65.38 -58.05 13.16 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.647 0.737 . . . . 73.25 110.908 -179.923 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . 0.526 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 53.2 Cg_endo -69.75 -25.92 28.14 Favored 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.725 2.283 . . . . 70.109999999999999 112.317 -179.97 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -63.23 -39.98 96.17 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.211 -0.45 . . . . 74.150000000000006 110.879 -179.956 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 44.9 t80 -74.5 -35.94 63.23 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.132 -0.485 . . . . 74.420000000000002 110.883 -179.909 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 21.9 tp -71.03 -54.14 12.24 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.183 -0.462 . . . . 75.049999999999997 110.879 -179.978 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 13.4 t -51.69 -30.01 20.45 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.202 -0.453 . . . . 74.340000000000003 111.168 179.904 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 37.7 ttp -59.72 -41.95 91.99 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.205 -0.452 . . . . 74.25 110.842 179.975 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 3.5 mtt -79.84 -28.87 40.03 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.228 -0.442 . . . . 74.329999999999998 110.865 179.952 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -74.85 -28.48 60.69 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.273 -0.421 . . . . 75.400000000000006 111.111 179.908 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 50.5 ttm-85 -66.19 -19.15 65.74 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.215 -0.448 . . . . 75.030000000000001 110.906 -179.919 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 15.8 pttp -51.45 -30.62 20.23 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.15 -0.477 . . . . 72.129999999999995 110.87 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 18.9 mtt -84.16 -32.58 24.55 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.26 -0.427 . . . . 75.019999999999996 110.898 179.869 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 31.0 tttt -68.79 174.42 4.37 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.233 -0.44 . . . . 72.420000000000002 110.903 179.937 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -111.51 77.14 1.02 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.176 -0.465 . . . . 74.040000000000006 110.87 179.849 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 7.7 p -154.43 33.35 0.42 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.187 -0.46 . . . . 73.329999999999998 111.149 -179.888 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -116.18 -25.93 7.41 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.21 -0.45 . . . . 71.310000000000002 110.851 179.946 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 50.3 m -52.16 -44.25 64.49 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.189 -0.46 . . . . 71.5 110.841 -179.744 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 8.7 tm-20 -54.3 -27.51 35.99 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.139 -0.482 . . . . 73.329999999999998 110.88 -179.934 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 12.8 tp10 -67.64 -39.21 84.64 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.146 -0.479 . . . . 73.340000000000003 110.899 -179.941 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -58.01 -37.23 73.93 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.174 -0.466 . . . . 72.519999999999996 110.862 -179.911 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 5.0 mp -75.12 -50.04 26.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.154 -0.476 . . . . 73.310000000000002 111.117 -179.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 20.4 ttt-85 -61.68 -28.23 69.25 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.188 -0.46 . . . . 74.030000000000001 110.865 -179.992 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 -68.19 -48.33 65.54 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.193 -0.458 . . . . 75.319999999999993 110.932 -179.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -74.04 -35.34 64.31 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.149 -0.478 . . . . 72.409999999999997 111.069 179.96 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 4.4 t80 -53.71 -47.78 70.2 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.256 -0.429 . . . . 75.129999999999995 110.863 -179.897 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 7.5 ptm180 -69.04 -25.95 64.73 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.131 -0.486 . . . . 74.019999999999996 110.875 -179.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 96.5 t -78.12 -27.4 14.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.194 -0.457 . . . . 75.230000000000004 111.131 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 21.9 m-85 -94.66 -26.14 16.45 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.134 -0.485 . . . . 73.340000000000003 110.888 -179.992 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 32.7 t0 -73.98 95.1 2.44 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.161 -0.472 . . . . 72.140000000000001 110.866 179.982 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 42.9 mmtt -78.68 -52.54 8.27 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.199 -0.455 . . . . 73.450000000000003 110.886 -180.0 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 52.1 p-10 -72.44 -9.15 58.17 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.211 -0.449 . . . . 72.239999999999995 110.838 179.917 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 59.79 28.37 65.59 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.709 -0.758 . . . . 73.299999999999997 112.487 -179.934 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 35.4 p-10 -81.77 -16.14 51.98 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.857 0.36 . . . . 63.240000000000002 110.881 -179.897 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 88.73 18.68 54.11 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.717 -0.754 . . . . 73.450000000000003 112.543 -179.952 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 23.6 m-85 -142.83 153.64 43.4 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.898 0.38 . . . . 72.129999999999995 110.918 -179.824 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 78.1 mt -119.25 127.04 75.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.089 -0.505 . . . . 72.420000000000002 111.133 179.954 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 6.4 p -112.44 -176.19 2.86 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.184 -0.462 . . . . 62.009999999999998 110.882 -179.946 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -74.31 -27.49 60.73 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.149 -0.478 . . . . 72.340000000000003 111.144 179.9 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -72.01 -47.68 50.1 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.21 -0.45 . . . . 71.340000000000003 111.09 179.951 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -67.78 -46.07 73.02 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.209 -0.45 . . . . 71.040000000000006 110.897 -179.922 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 21.2 tp -52.87 -39.56 62.74 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.109 -0.496 . . . . 75.530000000000001 110.936 179.986 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 63.0 ttp85 -55.46 -38.7 69.41 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.177 -0.465 . . . . 74.319999999999993 110.874 179.939 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 40.8 t60 -66.83 -34.37 77.67 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.171 -0.468 . . . . 72.150000000000006 110.862 -179.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 88.6 t -72.0 -51.18 32.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.21 -0.45 . . . . 74.200000000000003 111.132 179.955 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 1.3 mmt -60.61 -43.72 97.12 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.184 -0.462 . . . . 75.239999999999995 110.869 179.929 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 9.7 p -54.03 -27.26 31.02 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.235 -0.439 . . . . 74.25 111.137 -179.929 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.9 t30 -70.78 -31.68 68.54 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.223 -0.444 . . . . 74.099999999999994 110.885 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 8.2 mt -71.19 -26.21 62.86 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.201 -0.454 . . . . 63.020000000000003 110.89 179.967 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 100.89 32.62 5.29 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.752 -0.737 . . . . 71.299999999999997 112.5 179.902 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 13.8 mm-40 -113.78 119.98 39.2 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.908 0.385 . . . . 73.099999999999994 110.896 -179.88 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 7.7 tptm -68.89 97.95 0.89 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.125 -0.488 . . . . 74.200000000000003 110.902 179.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 16.4 mt -133.01 119.41 20.03 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.244 -0.434 . . . . 73.219999999999999 110.896 179.929 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 82.2 p -84.22 174.31 10.3 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.183 -0.462 . . . . 62.32 111.126 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -52.68 -42.93 65.22 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.23 -0.441 . . . . 70.510000000000005 110.884 179.881 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -62.29 -33.39 74.56 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.194 -0.457 . . . . 65.319999999999993 110.862 -179.882 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -70.84 -39.42 72.97 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.151 -0.477 . . . . 74.010000000000005 110.867 -179.91 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 21.9 t -65.25 -31.27 53.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.173 -0.467 . . . . 75.450000000000003 111.143 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 20.0 t0 -51.95 -46.11 64.62 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.133 -0.485 . . . . 73.430000000000007 110.905 179.919 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 13.3 tp10 -56.57 -29.6 62.21 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.198 -0.455 . . . . 73.400000000000006 110.878 -179.947 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 55.7 mtp -75.42 -59.51 2.72 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.171 -0.468 . . . . 74.109999999999999 110.913 179.957 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 35.9 mm -53.95 -35.69 28.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.216 -0.447 . . . . 75.510000000000005 111.119 179.948 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 1.6 tmt_? -63.33 -31.9 73.17 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.137 -0.483 . . . . 75.420000000000002 110.904 179.939 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -74.8 -52.39 11.58 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.203 -0.453 . . . . 64.25 110.887 -179.947 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -65.13 -34.44 78.4 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.19 -0.459 . . . . 75.439999999999998 111.081 179.957 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 49.3 t0 -68.38 86.73 0.29 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.247 -0.433 . . . . 74.049999999999997 110.853 179.981 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 61.1 mt -79.86 -46.21 22.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.228 -0.442 . . . . 74.430000000000007 111.17 179.982 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 21.2 p30 -72.8 -8.67 56.6 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.173 -0.467 . . . . 73.530000000000001 110.862 179.815 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 62.81 43.05 99.52 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.751 -0.737 . . . . 63.109999999999999 112.488 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 34.5 p-10 -88.3 -15.93 34.43 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.847 0.356 . . . . 71.329999999999998 110.907 -179.991 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 103.91 2.45 45.81 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.701 -0.761 . . . . 52.039999999999999 112.491 -179.957 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 4.1 tt0 -149.19 172.26 15.11 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.816 0.341 . . . . 72.439999999999998 110.894 -179.862 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 136' ' ' VAL . . . . . . . . . . . . . 86.5 t -107.84 111.91 37.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.192 -0.458 . . . . 74.430000000000007 111.135 179.939 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 43.6 p-10 -92.52 166.61 12.43 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.183 -0.462 . . . . 65.430000000000007 110.908 179.97 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 52.1 t80 -51.98 -46.79 64.98 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.169 -0.469 . . . . 74.439999999999998 110.949 -179.948 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -52.01 -43.77 63.82 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.116 -0.493 . . . . 75.530000000000001 110.847 -179.947 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 24.1 mt-10 -75.11 -31.86 61.24 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.204 -0.453 . . . . 62.509999999999998 110.877 -179.911 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 6.2 t80 -68.07 -35.35 78.06 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.114 -0.494 . . . . 75.409999999999997 110.902 -179.895 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 92.7 t -71.23 -42.14 74.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.161 -0.472 . . . . 75.0 111.15 179.932 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 18.4 tt0 -71.07 -28.55 64.43 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.156 -0.475 . . . . 73.109999999999999 110.89 -179.993 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 6.2 tpt -74.0 -55.24 6.38 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.211 -0.449 . . . . 75.329999999999998 110.911 179.927 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 11.9 ttm -66.09 -33.87 76.77 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.219 -0.446 . . . . 75.310000000000002 110.912 179.927 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 2.0 m -99.4 21.31 12.27 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.235 -0.439 . . . . 72.239999999999995 111.177 -179.961 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -51.94 126.34 17.99 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.143 -0.48 . . . . 72.540000000000006 111.081 179.88 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.286 0 CA-C-N 116.202 -0.454 . . . . 73.120000000000005 110.883 179.971 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' M' M ' 8' ' ' LEU . . . . . . . . . . . . . 4.5 mm? . . . . . 0 C--O 1.232 0.15 0 CA-C-O 120.839 0.352 . . . . 73.140000000000001 110.895 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' M' M ' 9' ' ' SER . . . . . . . . . . . . . 7.9 t 61.32 175.98 0.11 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.195 -0.457 . . . . 71.129999999999995 110.837 -179.952 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' M' M ' 10' ' ' GLY . . . . . . . . . . . . . . . 148.62 -36.97 1.06 Allowed Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.759 -0.734 . . . . 70.450000000000003 112.46 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' M' M ' 11' ' ' GLY . . . . . . . . . . . . . . . -101.94 48.64 1.07 Allowed Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.752 -0.737 . . . . 74.510000000000005 112.499 -179.907 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' M' M ' 12' ' ' GLU . . . . . . . . . . . . . 81.3 mm-40 -149.05 -174.36 4.62 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.928 0.394 . . . . 75.230000000000004 110.898 -179.849 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' M' M ' 13' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -87.64 75.8 8.98 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.18 -0.464 . . . . 73.099999999999994 110.897 -179.974 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' M' M ' 14' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -102.35 25.22 9.22 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.193 -0.458 . . . . 72.519999999999996 110.887 179.811 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' M' M ' 15' ' ' LYS . . . . . . . . . . . . . 7.4 mtmp? -75.36 -44.42 45.2 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.146 -0.479 . . . . 73.310000000000002 110.881 -179.998 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' M' M ' 16' ' ' TRP . . . . . . . . . . . . . 19.2 m95 -51.99 -38.95 58.53 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.184 -0.462 . . . . 73.319999999999993 110.978 179.917 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' M' M ' 17' ' ' GLU . . . . . . . . . . . . . 30.9 tp10 -56.17 -32.21 64.12 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.205 -0.452 . . . . 75.140000000000001 110.833 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' M' M ' 18' ' ' LYS . . . . . . . . . . . . . 6.4 ttpm? -63.36 -29.22 70.56 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.178 -0.464 . . . . 74.540000000000006 110.923 179.986 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' M' M ' 19' ' ' ILE . . . . . . . . . . . . . 28.8 mt -86.48 -25.13 6.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.192 -0.458 . . . . 72.409999999999997 111.166 179.86 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' M' M ' 20' ' ' ARG . . . . . . . . . . . . . 22.6 ttp180 -68.73 -26.4 65.24 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.17 -0.468 . . . . 75.150000000000006 110.863 179.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' M' M ' 21' ' ' LEU . . . . . . . . . . . . . 6.9 mt 63.03 -171.68 0.17 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.186 -0.461 . . . . 73.439999999999998 110.912 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' M' M ' 22' ' ' ARG . . . . . . . . . . . . . 27.9 mtm180 -63.18 148.73 92.46 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.557 0.694 . . . . 74.439999999999998 110.924 179.936 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' M' M ' 23' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.69 140.72 43.65 Favored 'Trans proline' 0 C--N 1.341 0.138 0 C-N-CA 122.665 2.244 . . . . 75.120000000000005 112.375 179.978 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' M' M ' 24' ' ' GLY . . . . . . . . . . . . . . . -171.61 -126.15 0.87 Allowed Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.754 -0.736 . . . . 43.43 112.504 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' M' M ' 25' ' ' GLY . . . . . . . . . . . . . . . 76.95 90.88 0.26 Allowed Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.746 -0.74 . . . . 74.150000000000006 112.45 -179.923 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' M' M ' 26' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -173.99 -38.27 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.839 0.352 . . . . 74.030000000000001 110.861 -179.99 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' M' M ' 27' ' ' LYS . . . . . . . . . . . . . 79.3 tttt -140.41 80.55 1.76 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.231 -0.44 . . . . 73.340000000000003 110.879 179.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' M' M ' 28' ' ' GLN . . . . . . . . . . . . . 21.4 mt-30 -143.37 98.0 3.18 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.197 -0.456 . . . . 74.209999999999994 110.948 179.962 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' M' M ' 29' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -115.77 -22.37 9.17 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.204 -0.453 . . . . 75.319999999999993 110.972 -179.878 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' M' M ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 63.35 22.1 13.12 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.089 -0.505 . . . . 74.510000000000005 110.889 179.878 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' M' M ' 31' ' ' LEU . . . . . . . . . . . . . 13.7 tp -137.25 -51.39 0.65 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.196 -0.456 . . . . 73.319999999999993 110.911 179.924 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' M' M ' 32' ' ' LYS . . . . . . . . . . . . . 3.0 ptpp? -49.55 -39.14 33.74 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.219 -0.446 . . . . 72.540000000000006 110.901 179.81 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' M' M ' 33' ' ' HIS . . . . . . . . . . . . . 10.7 t-160 -50.09 -41.26 47.92 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.227 -0.442 . . . . 73.129999999999995 110.861 179.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' M' M ' 34' ' ' ILE . . . . . . . . . . . . . 65.0 mt -50.37 -39.32 16.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.19 -0.459 . . . . 72.540000000000006 111.148 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' M' M ' 35' ' ' VAL . . . . . . . . . . . . . 61.5 t -49.16 -40.28 13.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.192 -0.458 . . . . 73.549999999999997 111.121 179.824 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' M' M ' 36' ' ' TRP . . . . . . . . . . . . . 21.7 m0 -58.93 -39.52 81.83 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.122 -0.49 . . . . 74.420000000000002 110.927 179.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' M' M ' 37' ' ' ALA . . . . . . . . . . . . . . . -64.13 -18.61 64.59 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.218 -0.446 . . . . 64.200000000000003 111.117 179.869 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' M' M ' 38' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -72.18 -17.98 61.9 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.237 -0.438 . . . . 74.150000000000006 110.872 -179.8 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' M' M ' 39' ' ' ARG . . . . . . . . . . . . . 4.6 tpt85 -60.75 -25.47 66.51 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.116 -0.493 . . . . 71.519999999999996 110.896 -179.914 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' M' M ' 40' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 -78.04 -47.99 17.12 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.131 -0.486 . . . . 71.329999999999998 110.874 -179.9 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' M' M ' 41' ' ' LEU . . . . . . . . . . . . . 17.3 mt -52.98 119.94 5.25 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.163 -0.471 . . . . 74.109999999999999 110.93 179.98 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' M' M ' 42' ' ' GLU . . . . . . . . . . . . . 14.0 mt-10 71.63 -69.47 0.18 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.149 -0.478 . . . . 74.209999999999994 110.891 179.915 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' M' M ' 43' ' ' ARG . . . . . . . . . . . . . 57.8 ttt180 . . . . . 0 C--N 1.329 -0.294 0 CA-C-N 116.161 -0.472 . . . . 73.239999999999995 110.851 -179.924 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 241' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 262' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 301' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 322' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.801 0.334 . . . . 73.010000000000005 111.099 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -122.39 -42.54 2.34 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.23 -0.441 . . . . 72.140000000000001 110.869 179.981 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 45.3 tt0 -115.03 110.41 19.55 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.192 -0.458 . . . . 65.099999999999994 110.944 -179.934 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 12.2 mt -110.85 137.19 48.81 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.198 -0.455 . . . . 75.329999999999998 110.906 -179.968 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -113.72 177.44 4.63 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.227 -0.442 . . . . 74.329999999999998 111.099 179.948 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 16.9 tp10 -52.41 -30.19 28.04 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.178 -0.464 . . . . 61.409999999999997 110.869 -179.999 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -66.64 -41.45 88.25 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.171 -0.468 . . . . 75.209999999999994 110.876 -179.939 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 19.4 tt0 -77.97 -40.06 40.5 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.162 -0.472 . . . . 72.310000000000002 110.936 -179.96 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 61.7 mt -68.78 -37.3 77.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.192 -0.458 . . . . 63.329999999999998 111.115 179.991 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -52.33 -49.85 63.45 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.166 -0.47 . . . . 64.120000000000005 111.082 179.852 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 17.0 mm-40 -54.92 -39.91 69.3 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.222 -0.445 . . . . 75.219999999999999 110.903 -179.916 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 31.4 m-85 -72.68 -41.2 65.59 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.148 -0.478 . . . . 74.140000000000001 110.852 -179.921 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 18.4 ttpp -54.81 -41.69 70.94 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.167 -0.47 . . . . 71.209999999999994 110.88 -179.99 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 8.4 tt0 -59.11 -36.12 74.63 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.228 -0.442 . . . . 73.400000000000006 110.884 179.948 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -67.91 -49.69 60.44 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.147 -0.478 . . . . 64.120000000000005 111.089 179.957 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 57.8 t80 -52.15 -49.52 63.59 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.226 -0.443 . . . . 74.439999999999998 110.913 -179.904 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 12.9 t -57.14 -30.39 64.39 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.151 -0.477 . . . . 70.230000000000004 110.893 -179.81 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 15.7 tp -66.06 -42.2 89.78 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.068 -0.514 . . . . 75.150000000000006 110.885 179.984 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 67.6 m-85 -78.02 -24.92 47.72 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.222 -0.445 . . . . 74.340000000000003 110.866 179.94 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 14.3 t0 -79.14 98.61 6.63 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.178 -0.464 . . . . 75.430000000000007 110.866 179.975 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 9.2 ttmm -66.49 -50.28 63.79 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.201 -0.454 . . . . 63.32 110.895 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 18.5 p-10 -81.46 -10.09 59.57 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.219 -0.446 . . . . 72.010000000000005 110.831 179.908 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 52.04 55.64 20.38 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.73 -0.748 . . . . 41.409999999999997 112.508 -179.889 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 29.2 p-10 -111.56 17.74 19.73 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.798 0.332 . . . . 72.329999999999998 110.849 -179.968 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 71.68 18.25 77.17 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.753 -0.737 . . . . 63.210000000000001 112.529 -179.907 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 22.3 p -145.46 156.53 43.8 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.714 0.292 . . . . 73.510000000000005 111.155 -179.85 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 28.8 mt -130.27 125.47 59.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.233 -0.44 . . . . 74.030000000000001 111.193 179.924 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 80.9 p -110.53 177.14 4.78 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.206 -0.452 . . . . 70.109999999999999 111.168 179.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 49.5 p -63.54 -25.47 68.26 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.22 -0.445 . . . . 74.430000000000007 111.115 -179.962 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 2.3 tppt? -79.96 -50.17 10.82 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.174 -0.466 . . . . 75.150000000000006 110.868 179.94 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 -67.89 -36.97 81.15 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.207 -0.451 . . . . 75.530000000000001 110.867 179.996 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.1 tt -73.83 -53.58 9.92 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.157 -0.474 . . . . 70.310000000000002 110.957 -179.973 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -51.92 -28.4 24.3 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.743 -0.741 . . . . 61.140000000000001 112.524 179.83 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 97.6 m -63.18 -58.99 5.37 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.883 0.373 . . . . 73.0 111.172 -179.866 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 51.6 t -57.72 -34.57 48.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.173 -0.467 . . . . 72.310000000000002 111.141 179.891 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 6.3 mmm -59.62 -49.01 79.41 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.158 -0.474 . . . . 73.329999999999998 110.874 179.968 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 29.7 ttp180 -57.17 -42.65 81.52 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.236 -0.438 . . . . 75.420000000000002 110.872 -179.945 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.6 t -57.91 -25.28 60.64 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.202 -0.454 . . . . 73.150000000000006 110.883 -179.814 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 83.3 mt -94.41 -10.39 32.64 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.084 -0.507 . . . . 70.439999999999998 110.876 -179.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 101.54 -6.63 55.4 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.76 -0.733 . . . . 75.200000000000003 112.468 179.93 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 15.8 tp60 -87.39 102.34 14.44 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.833 0.349 . . . . 75.099999999999994 110.9 -179.853 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 6.1 t-20 -109.85 76.75 0.98 Allowed Pre-proline 0 C--N 1.33 -0.279 0 CA-C-O 121.574 0.702 . . . . 73.5 110.887 -179.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.79 168.0 22.86 Favored 'Trans proline' 0 C--O 1.232 0.187 0 C-N-CA 122.709 2.273 . . . . 72.420000000000002 112.351 179.937 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 79.0 p -84.68 161.78 19.94 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.237 -0.438 . . . . 64.439999999999998 111.118 -179.949 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 94.1 mt-10 -52.41 -38.9 60.14 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.17 -0.468 . . . . 74.430000000000007 110.862 179.983 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.32 -39.28 65.39 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.183 -0.462 . . . . 72.420000000000002 111.051 179.957 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -62.09 -47.55 84.13 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.232 -0.44 . . . . 73.25 110.906 -179.923 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 22.0 mt -55.43 -47.48 75.91 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.159 -0.473 . . . . 71.310000000000002 110.894 -179.984 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 37.1 tp60 -71.86 -28.1 63.32 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.216 -0.447 . . . . 73.310000000000002 110.897 179.938 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -56.21 -49.77 73.14 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.218 -0.446 . . . . 74.400000000000006 110.888 179.904 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 6.0 ptp -69.85 -36.28 75.41 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.191 -0.459 . . . . 75.230000000000004 110.894 -179.986 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 87.3 mt -63.78 -41.35 92.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.249 -0.432 . . . . 73.310000000000002 111.153 179.922 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 34.5 m-20 -70.38 -31.7 69.05 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.18 -0.464 . . . . 73.230000000000004 110.907 179.935 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -71.62 -25.09 62.01 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.142 -0.481 . . . . 75.030000000000001 110.851 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 29.1 m -106.65 7.2 9.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.196 -0.456 . . . . 52.32 111.119 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -82.62 99.77 9.77 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.192 -0.458 . . . . 73.209999999999994 110.843 179.961 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.4 -33.85 17.76 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.148 -0.478 . . . . 72.200000000000003 111.147 179.932 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 2.6 p-10 -92.52 -0.57 57.32 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.199 -0.455 . . . . 75.230000000000004 110.869 179.945 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 50.85 60.94 6.5 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.744 -0.741 . . . . 72.109999999999999 112.517 -179.899 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 50.9 p-10 -114.55 -15.78 11.97 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.915 0.388 . . . . 61.240000000000002 110.901 -179.873 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 95.43 15.71 42.87 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.726 -0.75 . . . . 62.340000000000003 112.503 179.963 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 22.5 p -152.68 175.45 12.81 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.795 0.331 . . . . 71.239999999999995 111.157 -179.922 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 27.0 mt -106.83 111.57 36.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.213 -0.449 . . . . 72.109999999999999 111.13 179.912 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -77.93 -172.78 2.83 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.158 -0.474 . . . . 72.019999999999996 110.856 179.89 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.528 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 2.4 t80 -64.93 -57.94 14.38 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.604 0.716 . . . . 73.340000000000003 110.9 -179.895 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . 0.528 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 53.8 Cg_endo -69.78 -28.74 24.76 Favored 'Trans proline' 0 C--N 1.341 0.159 0 C-N-CA 122.677 2.251 . . . . 74.450000000000003 112.353 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 18.2 mt-10 -60.97 -39.73 90.72 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.188 -0.46 . . . . 72.150000000000006 110.875 -179.984 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 20.1 t80 -74.3 -36.23 63.72 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.094 -0.503 . . . . 75.329999999999998 110.848 -179.864 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 27.7 tp -69.53 -53.82 17.15 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.191 -0.459 . . . . 74.530000000000001 110.913 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 14.7 t -53.08 -27.95 22.74 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.193 -0.458 . . . . 61.229999999999997 111.134 179.934 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 42.6 ttp -64.4 -49.9 69.72 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.27 -0.423 . . . . 74.450000000000003 110.856 179.914 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 1.2 mtt -53.33 -44.15 68.24 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.244 -0.435 . . . . 63.229999999999997 110.849 179.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -74.89 -33.26 62.02 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.229 -0.441 . . . . 61.329999999999998 111.109 179.933 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 20.1 tpp180 -62.28 -18.46 61.33 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.201 -0.454 . . . . 74.129999999999995 110.836 -179.887 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 13.8 pttp -50.81 -31.05 15.84 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.181 -0.463 . . . . 72.200000000000003 110.878 179.954 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 25.5 tpp -58.33 -36.18 73.01 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.254 -0.43 . . . . 74.239999999999995 110.866 179.903 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 5.7 tttp -68.79 -169.77 0.19 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.281 -0.418 . . . . 62.310000000000002 110.881 179.924 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 16.5 t0 -73.06 130.8 41.13 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.202 -0.454 . . . . 71.549999999999997 110.87 179.875 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 1.7 p -157.17 23.24 0.31 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.182 -0.463 . . . . 60.409999999999997 111.12 -179.912 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -68.63 -13.47 62.38 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.259 -0.428 . . . . 72.319999999999993 110.863 179.904 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 8.1 t -51.79 -30.04 21.44 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.213 -0.448 . . . . 75.120000000000005 110.856 -179.755 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -89.58 -49.82 6.44 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.163 -0.472 . . . . 73.219999999999999 110.893 -179.993 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 45.9 tp10 -53.68 -41.91 67.39 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.204 -0.453 . . . . 74.329999999999998 110.897 -179.982 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -56.88 -28.27 61.59 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.162 -0.472 . . . . 75.310000000000002 110.87 -179.928 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 62.1 mt -74.88 -47.12 38.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.159 -0.473 . . . . 75.219999999999999 111.161 179.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 44.8 ttp85 -68.82 -52.25 32.07 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.164 -0.471 . . . . 74.109999999999999 110.845 179.977 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 16.0 tp10 -54.54 -53.48 53.9 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.24 -0.436 . . . . 74.25 110.908 -179.937 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -53.36 -50.74 64.43 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.127 -0.488 . . . . 74.340000000000003 111.12 179.911 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 5.9 t80 -52.12 -51.28 58.84 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.22 -0.445 . . . . 74.329999999999998 110.899 -179.957 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 60.0 ttt-85 -59.93 -45.05 93.84 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.199 -0.455 . . . . 65.140000000000001 110.873 -179.93 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 91.6 t -53.94 -45.47 63.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.211 -0.45 . . . . 72.319999999999993 111.172 179.954 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 10.7 m-85 -76.39 -26.35 55.49 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.167 -0.47 . . . . 73.540000000000006 110.873 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 14.1 t0 -68.11 96.77 0.65 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.159 -0.473 . . . . 72.140000000000001 110.889 179.958 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 17.3 mmtt -75.16 -53.2 9.24 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.164 -0.471 . . . . 64.099999999999994 110.923 179.973 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 52.9 p30 -77.09 -9.07 58.49 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.215 -0.448 . . . . 73.349999999999994 110.808 179.919 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 59.6 26.51 62.42 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.74 -0.743 . . . . 71.5 112.459 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 37.8 p-10 -81.9 -16.12 51.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.878 0.37 . . . . 73.040000000000006 110.919 -179.905 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 90.08 18.76 49.21 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.773 -0.727 . . . . 60.119999999999997 112.483 179.927 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 15.0 m-85 -140.41 132.38 27.76 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.858 0.361 . . . . 72.129999999999995 110.917 -179.779 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 62.2 mt -101.2 135.04 39.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.138 -0.483 . . . . 72.040000000000006 111.151 179.902 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 89.5 p -117.1 -177.97 3.33 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.167 -0.469 . . . . 61.130000000000003 110.843 -179.881 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -70.32 -35.51 73.69 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.139 -0.482 . . . . 74.299999999999997 111.058 179.922 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -71.9 -35.28 69.66 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.246 -0.433 . . . . 63.530000000000001 111.104 179.931 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -76.88 -46.64 23.78 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.226 -0.443 . . . . 74.510000000000005 110.888 -179.909 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 19.0 tp -52.96 -48.01 67.72 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.175 -0.466 . . . . 74.409999999999997 110.893 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 59.3 ttp85 -51.99 -40.04 60.31 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.199 -0.455 . . . . 72.129999999999995 110.858 179.975 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 13.5 t60 -55.85 -34.4 65.39 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.187 -0.46 . . . . 70.430000000000007 110.838 179.994 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 54.5 t -72.59 -52.03 25.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.235 -0.439 . . . . 75.209999999999994 111.122 -179.993 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 10.3 mmt -53.99 -28.12 35.91 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.153 -0.476 . . . . 72.409999999999997 110.874 179.908 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 4.0 m -66.9 -37.09 83.73 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.198 -0.455 . . . . 64.120000000000005 111.159 -179.907 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 43.0 t-20 -73.48 -26.12 60.76 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.212 -0.449 . . . . 73.430000000000007 110.904 179.975 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -70.69 -25.89 63.18 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.165 -0.47 . . . . 72.209999999999994 110.934 179.96 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 100.97 19.85 15.89 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.757 -0.735 . . . . 53.219999999999999 112.5 179.873 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -111.34 115.68 29.71 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.931 0.396 . . . . 74.400000000000006 110.892 -179.896 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 40.3 pttt -70.65 121.53 18.08 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.123 -0.489 . . . . 71.510000000000005 110.935 179.923 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 11.3 mt -143.33 161.0 39.49 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.235 -0.439 . . . . 74.329999999999998 110.935 179.947 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 67.9 p -118.59 174.33 6.33 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.205 -0.452 . . . . 73.420000000000002 111.089 179.993 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 47.8 m-20 -52.04 -48.35 64.63 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.182 -0.463 . . . . 64.430000000000007 110.865 179.9 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -60.67 -33.44 72.83 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.166 -0.47 . . . . 75.219999999999999 110.945 -179.929 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -68.97 -44.81 72.17 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.133 -0.485 . . . . 75.109999999999999 110.904 -179.979 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 63.3 t -58.04 -33.32 46.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.174 -0.466 . . . . 71.230000000000004 111.106 179.963 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -51.97 -43.76 63.7 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.229 -0.441 . . . . 64.310000000000002 110.863 179.934 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 22.9 tp10 -56.33 -31.52 63.8 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.202 -0.454 . . . . 75.420000000000002 110.916 -179.928 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 80.0 mtp -76.03 -59.5 2.73 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.16 -0.473 . . . . 74.209999999999994 110.891 179.938 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 34.8 mm -53.99 -35.74 29.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.198 -0.455 . . . . 73.430000000000007 111.097 179.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 9.6 tpt180 -65.43 -31.76 73.02 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.187 -0.46 . . . . 75.129999999999995 110.842 179.991 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -71.97 -49.71 35.0 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.202 -0.454 . . . . 72.209999999999994 110.852 -179.908 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -70.39 -33.66 71.66 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.208 -0.451 . . . . 61.219999999999999 111.087 179.936 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 50.7 t0 -68.41 86.63 0.29 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.21 -0.45 . . . . 71.299999999999997 110.835 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 59.1 mt -79.98 -45.33 22.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.18 -0.464 . . . . 75.349999999999994 111.148 179.962 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 23.1 p30 -72.69 -8.82 57.24 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.168 -0.469 . . . . 61.020000000000003 110.833 179.866 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 62.8 43.76 98.47 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.725 -0.75 . . . . 34.229999999999997 112.481 -179.925 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 32.5 p-10 -89.33 -16.05 31.99 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.868 0.365 . . . . 64.319999999999993 110.882 -179.961 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 102.66 3.37 49.74 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.724 -0.75 . . . . 63.340000000000003 112.478 -179.964 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 3.8 tt0 -149.26 172.22 15.23 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.816 0.341 . . . . 74.140000000000001 110.923 -179.87 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 136' ' ' VAL . . . . . . . . . . . . . 98.9 t -113.18 114.87 48.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.248 -0.433 . . . . 73.420000000000002 111.192 179.94 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 41.9 p-10 -93.28 167.87 11.46 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.174 -0.466 . . . . 74.109999999999999 110.928 -179.975 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 14.1 t80 -51.96 -43.65 63.61 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.218 -0.446 . . . . 72.519999999999996 110.971 -179.931 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -55.74 -55.14 35.79 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.148 -0.478 . . . . 72.010000000000005 110.881 179.96 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 88.8 mt-10 -62.08 -45.42 93.58 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.172 -0.467 . . . . 65.319999999999993 110.9 -179.941 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 69.4 t80 -54.88 -54.94 36.03 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.129 -0.487 . . . . 74.129999999999995 110.903 -179.914 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 96.8 t -53.86 -43.35 56.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.13 -0.486 . . . . 74.239999999999995 111.172 179.91 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -64.23 -58.42 6.62 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.155 -0.475 . . . . 71.25 110.934 179.978 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 11.3 tpt -57.5 -24.83 58.17 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.235 -0.439 . . . . 74.219999999999999 110.909 179.927 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -86.75 -24.14 25.21 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.2 -0.455 . . . . 73.439999999999998 110.898 179.932 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 97.3 m -89.15 -24.85 22.1 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.234 -0.439 . . . . 74.400000000000006 111.119 -179.934 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -56.27 156.97 5.2 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.255 -0.43 . . . . 70.340000000000003 111.101 179.868 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 116.25 -0.432 . . . . 75.409999999999997 110.921 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' M' M ' 8' ' ' LEU . . . . . . . . . . . . . 5.2 mp . . . . . 0 C--O 1.232 0.137 0 CA-C-O 120.768 0.318 . . . . 73.140000000000001 110.913 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' M' M ' 9' ' ' SER . . . . . . . . . . . . . 1.3 m -131.73 169.79 15.7 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.243 -0.435 . . . . 75.340000000000003 110.901 -179.917 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' M' M ' 10' ' ' GLY . . . . . . . . . . . . . . . -129.2 150.44 18.86 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.719 -0.753 . . . . 72.340000000000003 112.454 -179.951 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' M' M ' 11' ' ' GLY . . . . . . . . . . . . . . . 153.81 -64.32 0.35 Allowed Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.777 -0.725 . . . . 73.420000000000002 112.52 -179.918 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' M' M ' 12' ' ' GLU . . . . . . . . . . . . . 5.7 pm0 -117.74 161.06 20.31 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.919 0.39 . . . . 74.109999999999999 110.847 -179.858 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' M' M ' 13' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -87.4 76.65 9.03 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.126 -0.488 . . . . 71.25 110.89 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' M' M ' 14' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -102.83 24.31 10.84 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.233 -0.44 . . . . 72.409999999999997 110.854 179.863 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' M' M ' 15' ' ' LYS . . . . . . . . . . . . . 7.2 mttp -63.5 -57.25 10.81 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.232 -0.44 . . . . 74.420000000000002 110.895 179.986 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' M' M ' 16' ' ' TRP . . . . . . . . . . . . . 67.2 m95 -52.82 -41.46 64.23 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.216 -0.447 . . . . 74.510000000000005 110.893 179.909 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' M' M ' 17' ' ' GLU . . . . . . . . . . . . . 15.4 tm-20 -57.4 -30.2 64.74 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.241 -0.436 . . . . 72.310000000000002 110.893 -179.929 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' M' M ' 18' ' ' LYS . . . . . . . . . . . . . 15.5 tttp -62.91 -28.03 69.78 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.176 -0.465 . . . . 75.209999999999994 110.875 179.946 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' M' M ' 19' ' ' ILE . . . . . . . . . . . . . 22.7 mt -98.66 -23.83 4.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.267 -0.424 . . . . 74.329999999999998 111.156 179.868 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' M' M ' 20' ' ' ARG . . . . . . . . . . . . . 30.6 ttt-85 -52.04 -30.18 24.48 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.185 -0.461 . . . . 75.409999999999997 110.836 -179.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' M' M ' 21' ' ' LEU . . . . . . . . . . . . . 4.8 mt 55.03 -175.02 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.216 -0.447 . . . . 64.329999999999998 110.889 179.982 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' M' M ' 22' ' ' ARG . . . . . . . . . . . . . 47.3 ttt180 -125.29 136.78 28.66 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.583 0.706 . . . . 74.25 110.861 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' M' M ' 23' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.78 128.44 16.01 Favored 'Trans proline' 0 C--N 1.341 0.157 0 C-N-CA 122.679 2.252 . . . . 75.549999999999997 112.346 179.957 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' M' M ' 24' ' ' GLY . . . . . . . . . . . . . . . -178.19 48.58 0.1 OUTLIER Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.727 -0.749 . . . . 73.530000000000001 112.458 179.973 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' M' M ' 25' ' ' GLY . . . . . . . . . . . . . . . -127.85 -133.48 3.75 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.768 -0.73 . . . . 71.310000000000002 112.525 -179.979 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' M' M ' 26' ' ' LYS . . . . . . . . . . . . . 22.6 ttpp -178.61 118.7 0.08 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.801 0.334 . . . . 65.239999999999995 110.879 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' M' M ' 27' ' ' LYS . . . . . . . . . . . . . 3.0 mmmp? -150.7 -76.54 0.14 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.242 -0.435 . . . . 74.120000000000005 110.867 179.839 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' M' M ' 28' ' ' GLN . . . . . . . . . . . . . 4.2 pt20 179.04 167.79 0.96 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.247 -0.433 . . . . 75.430000000000007 110.883 179.94 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' M' M ' 29' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 -66.8 176.9 1.82 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.157 -0.474 . . . . 71.230000000000004 110.905 -179.831 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' M' M ' 30' ' ' LYS . . . . . . . . . . . . . 2.1 pttp -107.37 15.85 24.52 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.117 -0.492 . . . . 75.030000000000001 110.857 179.938 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' M' M ' 31' ' ' LEU . . . . . . . . . . . . . 7.2 tp -124.33 -48.78 1.82 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.228 -0.442 . . . . 71.25 110.918 179.935 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' M' M ' 32' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -47.21 -40.15 15.62 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.212 -0.449 . . . . 71.209999999999994 110.937 179.809 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' M' M ' 33' ' ' HIS . . . . . . . . . . . . . 79.9 t60 -48.12 -46.35 34.04 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.148 -0.478 . . . . 75.200000000000003 110.865 179.913 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' M' M ' 34' ' ' ILE . . . . . . . . . . . . . 3.3 mt -51.77 -38.57 22.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.214 -0.448 . . . . 75.430000000000007 111.096 179.996 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' M' M ' 35' ' ' VAL . . . . . . . . . . . . . 48.5 t -50.1 -38.9 15.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.18 -0.464 . . . . 60.509999999999998 111.107 179.886 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' M' M ' 36' ' ' TRP . . . . . . . . . . . . . 26.6 m0 -59.29 -39.03 81.67 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.188 -0.46 . . . . 73.209999999999994 110.914 179.954 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' M' M ' 37' ' ' ALA . . . . . . . . . . . . . . . -63.94 -18.39 64.2 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.225 -0.443 . . . . 70.140000000000001 111.095 179.911 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' M' M ' 38' ' ' SER . . . . . . . . . . . . . 2.5 m -71.07 -17.94 62.58 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.243 -0.435 . . . . 73.230000000000004 110.857 -179.803 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' M' M ' 39' ' ' ARG . . . . . . . . . . . . . 14.9 mmm180 -52.07 -29.96 23.71 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.151 -0.477 . . . . 73.409999999999997 110.849 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' M' M ' 40' ' ' GLU . . . . . . . . . . . . . 9.4 tt0 -92.37 -40.71 10.74 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.21 -0.45 . . . . 64.439999999999998 110.915 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' M' M ' 41' ' ' LEU . . . . . . . . . . . . . 5.0 mt -52.31 170.13 0.07 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.162 -0.472 . . . . 72.430000000000007 110.931 179.991 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' M' M ' 42' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -124.64 -50.21 1.74 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.176 -0.466 . . . . 61.340000000000003 110.883 179.944 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' M' M ' 43' ' ' ARG . . . . . . . . . . . . . 10.3 mmt85 . . . . . 0 C--N 1.329 -0.286 0 CA-C-N 116.158 -0.474 . . . . 74.219999999999999 110.872 -179.891 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 241' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 262' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 301' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 322' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.158 0 CA-C-O 120.775 0.321 . . . . 72.450000000000003 111.116 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -100.94 34.56 2.45 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.227 -0.442 . . . . 74.219999999999999 110.856 179.982 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 48.7 mt-30 -144.64 100.89 3.59 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.183 -0.462 . . . . 71.329999999999998 110.901 -179.913 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 68.3 mt -96.12 149.13 21.96 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.16 -0.473 . . . . 73.109999999999999 110.878 -179.928 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 7.5 p -120.67 174.48 6.55 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.211 -0.449 . . . . 75.400000000000006 111.13 179.936 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -52.92 -30.0 31.82 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.236 -0.438 . . . . 74.109999999999999 110.875 -180.0 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -65.9 -41.88 90.95 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.167 -0.47 . . . . 75.409999999999997 110.836 -179.89 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 1.6 tp-100 -77.92 -41.46 36.34 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.163 -0.471 . . . . 72.299999999999997 110.904 -179.924 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 62.0 mt -67.04 -37.14 78.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.212 -0.449 . . . . 74.109999999999999 111.124 179.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -51.95 -49.9 62.27 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.191 -0.459 . . . . 63.539999999999999 111.098 179.815 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 25.3 mm-40 -54.87 -52.24 63.45 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.179 -0.464 . . . . 74.420000000000002 110.931 -179.966 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 66.0 m-85 -60.04 -44.17 94.83 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.123 -0.489 . . . . 73.430000000000007 110.933 -179.953 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 38.0 ttmt -51.98 -33.5 38.26 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.088 -0.505 . . . . 75.319999999999993 110.866 -179.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -68.74 -36.65 78.66 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.234 -0.439 . . . . 75.430000000000007 110.904 179.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -66.52 -52.28 47.52 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.14 -0.482 . . . . 74.140000000000001 111.076 179.931 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 42.4 t80 -52.6 -47.44 66.94 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.19 -0.459 . . . . 74.439999999999998 110.859 -179.898 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.6 m -59.48 -28.98 67.5 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.156 -0.475 . . . . 63.299999999999997 110.885 -179.793 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 15.3 tp -68.59 -47.54 66.48 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.111 -0.495 . . . . 75.400000000000006 110.897 -179.995 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 62.1 m-85 -71.67 -26.09 62.39 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.178 -0.465 . . . . 70.030000000000001 110.89 179.928 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 18.6 t0 -86.33 98.47 10.99 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.154 -0.475 . . . . 71.420000000000002 110.845 -179.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 39.6 mtpt -71.86 -53.12 14.21 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.216 -0.447 . . . . 75.030000000000001 110.862 -179.977 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 26.3 p-10 -73.5 -10.11 59.39 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.244 -0.435 . . . . 73.439999999999998 110.802 179.912 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 52.03 46.45 55.88 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.792 -0.718 . . . . 52.450000000000003 112.451 -179.946 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 26.7 p-10 -88.46 -15.73 34.62 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.891 0.377 . . . . 71.5 110.906 179.993 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 105.32 -11.73 47.65 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.696 -0.764 . . . . 65.030000000000001 112.508 -179.902 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 51.6 p -131.31 130.71 43.09 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.755 0.312 . . . . 72.230000000000004 111.157 -179.886 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 29.8 mt -90.72 135.82 25.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.206 -0.452 . . . . 65.340000000000003 111.138 179.898 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 15.0 p -115.97 -179.37 3.64 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.195 -0.457 . . . . 61.039999999999999 111.176 179.936 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 8.2 p -68.69 -33.02 73.25 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.227 -0.442 . . . . 73.25 111.167 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 14.8 ptpt -69.6 -41.42 75.75 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.194 -0.457 . . . . 75.319999999999993 110.889 179.878 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 62.1 mt-10 -75.9 -35.4 59.83 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.22 -0.445 . . . . 75.340000000000003 110.924 179.968 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.1 tt -74.31 -53.78 9.01 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.136 -0.484 . . . . 75.549999999999997 110.904 -179.962 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -52.1 -43.28 56.08 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.801 -0.714 . . . . 65.409999999999997 112.488 179.904 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 96.0 m -56.97 -55.07 39.45 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.816 0.341 . . . . 75.299999999999997 111.146 -179.896 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 100.0 t -51.67 -50.22 31.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.21 -0.45 . . . . 72.400000000000006 111.096 179.937 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 7.5 mtp -51.97 -39.07 58.77 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.16 -0.473 . . . . 75.400000000000006 110.905 179.932 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 30.1 ttt85 -54.11 -40.15 67.04 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.179 -0.464 . . . . 73.030000000000001 110.837 -179.9 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 3.8 t -76.8 -28.39 55.59 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.179 -0.464 . . . . 71.5 110.904 -179.809 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 58.6 mt -76.98 -21.49 54.63 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.127 -0.488 . . . . 74.540000000000006 110.909 179.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 101.45 31.11 5.65 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.753 -0.737 . . . . 73.319999999999993 112.476 179.858 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 2.2 tp-100 -116.96 140.32 49.61 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.842 0.353 . . . . 75.209999999999994 110.856 -179.85 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 29.8 t30 -109.87 76.8 0.99 Allowed Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.63 0.729 . . . . 72.329999999999998 110.913 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.75 140.0 41.64 Favored 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.71 2.274 . . . . 64.349999999999994 112.311 179.951 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 19.9 p -97.29 158.35 15.5 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.2 -0.454 . . . . 74.540000000000006 111.157 -179.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -51.94 -43.41 63.46 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.225 -0.443 . . . . 75.420000000000002 110.914 179.966 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.36 -32.93 64.81 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.18 -0.463 . . . . 65.319999999999993 111.088 179.937 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 11.0 tt0 -67.57 -50.77 56.85 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.194 -0.457 . . . . 75.120000000000005 110.89 -179.936 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 45.9 mt -55.05 -51.85 65.02 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.172 -0.467 . . . . 70.200000000000003 110.951 179.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 29.8 tp60 -57.24 -29.07 63.47 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.148 -0.478 . . . . 73.219999999999999 110.94 179.89 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -72.17 -37.6 69.3 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.208 -0.451 . . . . 72.099999999999994 110.881 179.964 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 5.7 mtp -63.7 -57.89 8.59 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.172 -0.467 . . . . 74.099999999999994 110.858 179.985 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 62.4 mt -54.89 -45.27 75.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.243 -0.435 . . . . 74.409999999999997 111.143 179.972 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 76.8 m-20 -66.32 -33.84 76.63 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.183 -0.462 . . . . 73.209999999999994 110.884 179.921 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -63.12 -30.56 71.68 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.212 -0.449 . . . . 75.010000000000005 110.861 -179.965 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 4.8 m -111.12 18.98 7.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.162 -0.472 . . . . 73.150000000000006 111.095 -179.987 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 31.5 t0 -89.99 93.06 9.25 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.205 -0.452 . . . . 65.439999999999998 110.889 179.893 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.16 -33.71 18.1 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.249 -0.432 . . . . 75.310000000000002 111.079 179.962 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 14.7 p30 -91.35 -0.15 57.61 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.226 -0.443 . . . . 65.420000000000002 110.868 179.962 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 52.35 59.54 8.86 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.726 -0.75 . . . . 70.409999999999997 112.496 -179.899 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 51.5 p-10 -114.48 -15.73 12.01 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.833 0.349 . . . . 70.230000000000004 110.919 -179.926 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 89.77 18.46 51.32 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.715 -0.755 . . . . 74.129999999999995 112.505 179.966 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 22.5 p -152.65 159.37 43.2 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.788 0.328 . . . . 54.32 111.167 -179.914 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 25.1 mt -91.94 109.48 21.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.215 -0.448 . . . . 75.400000000000006 111.137 179.907 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.4 t0 -73.82 -176.42 2.43 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.152 -0.476 . . . . 70.510000000000005 110.867 179.875 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.522 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 2.5 t80 -62.85 -58.32 17.19 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-O 121.652 0.739 . . . . 74.120000000000005 110.914 -179.887 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . 0.522 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 53.7 Cg_endo -69.81 -30.02 22.7 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.697 2.264 . . . . 74.540000000000006 112.344 179.982 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 -57.24 -41.47 79.6 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.205 -0.452 . . . . 73.409999999999997 110.918 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 24.2 t80 -74.14 -36.1 64.12 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.106 -0.497 . . . . 75.400000000000006 110.886 -179.971 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 28.9 tp -65.48 -53.65 39.5 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.155 -0.475 . . . . 75.439999999999998 110.887 -179.937 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 11.2 t -54.02 -26.69 27.61 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.247 -0.433 . . . . 74.439999999999998 111.129 179.967 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 42.9 ttp -70.67 -35.46 72.85 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.208 -0.451 . . . . 73.549999999999997 110.89 179.937 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 11.1 mtp -77.69 -33.72 53.14 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.213 -0.449 . . . . 74.430000000000007 110.888 179.938 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -74.84 -46.05 39.08 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.227 -0.442 . . . . 54.310000000000002 111.059 179.958 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 22.8 ttm180 -52.53 -34.8 51.6 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.238 -0.437 . . . . 75.530000000000001 110.926 -179.909 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -81.34 -27.09 35.1 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.15 -0.477 . . . . 74.349999999999994 110.835 179.978 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 11.0 tpt -60.7 -26.15 66.93 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.242 -0.435 . . . . 73.200000000000003 110.868 179.886 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 20.0 tptp -151.04 89.66 1.54 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.234 -0.439 . . . . 74.420000000000002 110.907 179.939 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -106.71 179.82 4.16 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.261 -0.427 . . . . 73.430000000000007 110.863 179.837 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 1.8 m -104.43 25.24 10.44 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.144 -0.48 . . . . 72.019999999999996 111.13 -179.927 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -86.66 -33.49 20.08 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.231 -0.44 . . . . 72.340000000000003 110.885 179.859 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 4.5 t -52.38 -37.05 55.41 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.197 -0.456 . . . . 71.030000000000001 110.868 -179.762 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 4.9 tm-20 -52.31 -29.86 25.53 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.1 -0.5 . . . . 63.109999999999999 110.91 -179.933 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 6.6 tt0 -63.88 -40.71 97.16 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.163 -0.472 . . . . 75.319999999999993 110.836 -179.906 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 11.1 tp10 -77.89 -38.47 45.69 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.15 -0.477 . . . . 71.530000000000001 110.898 -179.914 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 54.8 mt -55.48 -51.0 62.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.131 -0.486 . . . . 72.329999999999998 111.133 179.988 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.16 -30.3 26.15 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.104 -0.498 . . . . 74.150000000000006 110.882 179.988 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 11.1 tt0 -76.41 -56.95 4.16 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.211 -0.449 . . . . 74.299999999999997 110.866 -179.953 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -54.82 -43.23 72.78 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.141 -0.482 . . . . 73.5 111.089 179.962 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 8.8 t80 -52.02 -51.19 59.01 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.226 -0.443 . . . . 75.209999999999994 110.892 -179.953 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 50.3 ttt-85 -58.84 -44.89 91.07 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.124 -0.489 . . . . 73.340000000000003 110.902 -179.939 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 57.6 t -54.67 -49.36 68.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.178 -0.465 . . . . 73.129999999999995 111.185 179.938 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 8.9 m-85 -70.92 -32.36 69.26 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.149 -0.478 . . . . 72.150000000000006 110.889 179.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 16.6 t0 -61.71 96.72 0.07 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.175 -0.466 . . . . 75.209999999999994 110.822 179.983 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 58.2 mmtt -76.24 -53.17 8.64 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.175 -0.466 . . . . 64.329999999999998 110.876 179.993 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 56.0 p-10 -76.02 -9.17 58.4 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.216 -0.447 . . . . 72.439999999999998 110.872 179.868 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 59.64 26.87 63.03 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.733 -0.746 . . . . 44.509999999999998 112.45 -179.96 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 42.4 p-10 -81.77 -16.17 51.87 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.863 0.363 . . . . 75.099999999999994 110.908 -179.956 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 91.89 18.75 42.63 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.748 -0.739 . . . . 73.420000000000002 112.494 -179.998 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 6.2 m-85 -136.42 159.32 42.12 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.855 0.36 . . . . 73.439999999999998 110.907 -179.802 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 62.8 mt -122.4 123.95 69.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.143 -0.48 . . . . 74.5 111.127 179.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 63.2 p -107.17 -172.58 2.11 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.175 -0.466 . . . . 54.119999999999997 110.835 -179.913 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -73.96 -36.6 64.6 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.112 -0.494 . . . . 73.420000000000002 111.056 179.935 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -72.0 -31.37 66.16 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.228 -0.442 . . . . 73.510000000000005 111.11 179.983 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -74.9 -48.69 23.39 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.163 -0.471 . . . . 71.530000000000001 110.882 -179.924 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 22.1 tp -54.02 -47.89 71.05 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.162 -0.472 . . . . 74.219999999999999 110.937 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 42.2 ttp85 -52.37 -44.53 65.33 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.182 -0.463 . . . . 71.450000000000003 110.904 179.911 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 11.1 t60 -58.45 -34.53 70.94 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.202 -0.453 . . . . 74.030000000000001 110.832 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 92.7 t -67.04 -52.2 46.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.201 -0.454 . . . . 73.150000000000006 111.175 179.948 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 4.2 mmt -64.2 -46.07 85.5 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.139 -0.482 . . . . 73.200000000000003 110.85 179.905 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 41.8 p -51.88 -37.16 51.18 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.24 -0.436 . . . . 64.310000000000002 111.174 -179.933 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 43.8 t30 -57.86 -33.7 68.96 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.211 -0.45 . . . . 72.340000000000003 110.916 179.953 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 15.3 mt -70.7 -23.9 62.55 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.151 -0.477 . . . . 72.400000000000006 110.908 179.943 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 101.06 32.93 5.13 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.714 -0.755 . . . . 74.319999999999993 112.428 179.883 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -110.07 116.27 31.26 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.92 0.391 . . . . 74.239999999999995 110.898 -179.918 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 29.3 tttm -60.73 120.29 9.79 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.153 -0.476 . . . . 73.540000000000006 110.931 179.96 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 19.8 mt -145.88 155.42 42.87 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.246 -0.434 . . . . 71.120000000000005 110.897 179.92 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 41.0 p -118.73 169.03 10.18 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.168 -0.469 . . . . 72.420000000000002 111.177 179.943 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 41.2 m-20 -53.07 -46.08 68.43 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.268 -0.424 . . . . 72.420000000000002 110.897 179.887 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 17.9 tt0 -63.54 -34.23 77.35 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.188 -0.46 . . . . 72.439999999999998 110.867 -179.921 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -67.23 -32.65 73.84 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.186 -0.461 . . . . 72.430000000000007 110.871 -179.902 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 92.8 t -69.48 -32.67 53.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.154 -0.475 . . . . 74.310000000000002 111.137 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 10.8 t0 -51.95 -46.92 64.92 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.18 -0.464 . . . . 71.299999999999997 110.878 179.948 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -55.74 -29.3 59.32 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.131 -0.486 . . . . 72.5 110.873 -179.898 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 1.2 mtp -75.37 -59.74 2.61 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.155 -0.475 . . . . 65.209999999999994 110.866 -179.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 35.5 mm -54.13 -35.61 29.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.215 -0.448 . . . . 75.329999999999998 111.11 179.977 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 51.2 ttt180 -63.03 -31.78 72.99 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.174 -0.466 . . . . 74.510000000000005 110.893 179.957 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 9.7 tt0 -75.33 -52.48 10.71 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.183 -0.462 . . . . 74.310000000000002 110.883 -179.893 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -64.92 -33.87 77.07 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.117 -0.492 . . . . 64.140000000000001 111.071 179.959 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 49.5 t0 -68.73 86.31 0.32 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.238 -0.437 . . . . 73.329999999999998 110.882 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 4.0 mt -79.91 -45.72 22.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.229 -0.442 . . . . 75.140000000000001 111.128 -179.952 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 22.0 p30 -72.77 -8.8 57.18 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.184 -0.462 . . . . 73.409999999999997 110.88 179.823 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 62.86 44.41 97.48 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.73 -0.748 . . . . 55.539999999999999 112.518 -179.891 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 31.8 p-10 -90.44 -15.95 29.92 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.841 0.353 . . . . 75.239999999999995 110.882 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 101.97 3.77 51.62 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.726 -0.75 . . . . 75.209999999999994 112.518 -179.906 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 4.4 tt0 -149.29 172.31 15.09 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.873 0.368 . . . . 75.409999999999997 110.91 -179.857 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 136' ' ' VAL . . . . . . . . . . . . . 66.9 t -114.78 111.09 34.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.187 -0.461 . . . . 62.130000000000003 111.166 179.964 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 45.4 p-10 -93.67 171.66 8.75 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.17 -0.468 . . . . 71.530000000000001 110.915 -179.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 86.9 t80 -56.18 -46.83 79.21 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.232 -0.44 . . . . 72.420000000000002 110.901 -179.901 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 22.1 tt0 -52.11 -44.56 64.51 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.097 -0.501 . . . . 74.349999999999994 110.914 -179.981 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 94.9 mt-10 -73.94 -40.26 63.2 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.166 -0.47 . . . . 71.549999999999997 110.87 -179.929 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 42.7 t80 -60.47 -41.34 93.97 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.176 -0.465 . . . . 74.450000000000003 110.884 -179.936 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 99.7 t -60.19 -49.46 84.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.165 -0.47 . . . . 72.239999999999995 111.162 179.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 29.7 tt0 -72.28 -23.47 61.19 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.191 -0.459 . . . . 75.530000000000001 110.911 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 10.8 tpt -74.99 -18.79 60.31 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.241 -0.436 . . . . 74.310000000000002 110.872 179.958 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 9.2 ttm -98.22 -32.93 11.31 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.214 -0.448 . . . . 74.329999999999998 110.894 179.94 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 5.0 t -73.35 -24.15 60.31 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.243 -0.435 . . . . 74.25 111.11 -179.91 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -65.94 141.72 58.12 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.216 -0.447 . . . . 73.040000000000006 111.096 179.838 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.3 0 CA-C-N 116.192 -0.458 . . . . 72.530000000000001 110.904 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' M' M ' 8' ' ' LEU . . . . . . . . . . . . . 6.9 tp . . . . . 0 C--O 1.231 0.089 0 CA-C-O 120.836 0.35 . . . . 75.329999999999998 110.945 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' M' M ' 9' ' ' SER . . . . . . . . . . . . . 6.9 t 55.97 -176.91 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.17 -0.468 . . . . 65.219999999999999 110.875 -179.895 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' M' M ' 10' ' ' GLY . . . . . . . . . . . . . . . -138.19 -79.48 0.08 OUTLIER Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.755 -0.736 . . . . 74.310000000000002 112.468 -179.953 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' M' M ' 11' ' ' GLY . . . . . . . . . . . . . . . 83.3 -54.31 4.95 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.754 -0.736 . . . . 72.409999999999997 112.527 -179.891 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' M' M ' 12' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -82.74 128.13 34.08 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.908 0.385 . . . . 72.409999999999997 110.853 -179.877 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' M' M ' 13' ' ' LEU . . . . . . . . . . . . . 15.0 tp -51.72 122.81 8.79 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.186 -0.461 . . . . 73.010000000000005 110.909 -179.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' M' M ' 14' ' ' ASP . . . . . . . . . . . . . 35.0 t0 -107.63 73.64 0.92 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.169 -0.469 . . . . 70.510000000000005 110.864 179.854 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' M' M ' 15' ' ' LYS . . . . . . . . . . . . . 3.0 mttp -62.65 -17.07 59.73 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.179 -0.464 . . . . 74.299999999999997 110.901 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' M' M ' 16' ' ' TRP . . . . . . . . . . . . . 73.9 m95 -50.85 -32.74 21.26 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.199 -0.455 . . . . 71.230000000000004 110.929 179.918 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' M' M ' 17' ' ' GLU . . . . . . . . . . . . . 59.1 tt0 -54.08 -34.54 60.41 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.218 -0.447 . . . . 75.209999999999994 110.914 179.998 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' M' M ' 18' ' ' LYS . . . . . . . . . . . . . 23.4 tttp -65.16 -28.55 69.48 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.152 -0.476 . . . . 71.420000000000002 110.908 179.953 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' M' M ' 19' ' ' ILE . . . . . . . . . . . . . 28.6 mt -90.7 -29.98 4.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.214 -0.448 . . . . 73.140000000000001 111.157 179.879 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' M' M ' 20' ' ' ARG . . . . . . . . . . . . . 39.0 ttp85 -54.32 -28.05 39.89 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.147 -0.479 . . . . 75.430000000000007 110.87 179.928 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' M' M ' 21' ' ' LEU . . . . . . . . . . . . . 5.0 mt 57.64 -175.13 0.07 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.182 -0.463 . . . . 73.450000000000003 110.914 -179.959 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' M' M ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -108.96 144.14 29.03 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.614 0.721 . . . . 73.299999999999997 110.829 179.97 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' M' M ' 23' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.81 -48.29 0.74 Allowed 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.652 2.235 . . . . 75.310000000000002 112.326 179.987 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' M' M ' 24' ' ' GLY . . . . . . . . . . . . . . . 87.56 -74.5 2.23 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.694 -0.765 . . . . 73.420000000000002 112.466 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' M' M ' 25' ' ' GLY . . . . . . . . . . . . . . . 156.45 -107.56 0.33 Allowed Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.77 -0.729 . . . . 62.539999999999999 112.515 -179.91 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' M' M ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 39.4 41.6 0.72 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.871 0.367 . . . . 74.299999999999997 110.911 -179.976 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' M' M ' 27' ' ' LYS . . . . . . . . . . . . . 11.7 mmmt -92.54 172.88 8.09 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.26 -0.427 . . . . 75.439999999999998 110.912 179.875 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' M' M ' 28' ' ' GLN . . . . . . . . . . . . . 36.0 mm-40 -55.29 -70.03 0.12 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.263 -0.426 . . . . 61.119999999999997 110.918 179.946 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' M' M ' 29' ' ' TYR . . . . . . . . . . . . . 5.0 m-85 -52.15 123.77 11.42 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.194 -0.457 . . . . 62.0 110.935 -179.869 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' M' M ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.02 34.91 4.58 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.133 -0.485 . . . . 75.140000000000001 110.891 179.913 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' M' M ' 31' ' ' LEU . . . . . . . . . . . . . 14.8 tp -124.39 -41.44 2.17 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.262 -0.426 . . . . 74.230000000000004 110.926 179.935 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' M' M ' 32' ' ' LYS . . . . . . . . . . . . . 42.6 tttt -49.57 -42.87 45.49 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.178 -0.465 . . . . 54.329999999999998 110.909 179.827 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' M' M ' 33' ' ' HIS . . . . . . . . . . . . . 80.7 t60 -50.33 -39.19 45.27 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.185 -0.461 . . . . 74.129999999999995 110.851 179.912 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' M' M ' 34' ' ' ILE . . . . . . . . . . . . . 62.3 mt -50.7 -39.46 18.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.204 -0.453 . . . . 75.230000000000004 111.138 179.987 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' M' M ' 35' ' ' VAL . . . . . . . . . . . . . 98.9 t -49.8 -39.22 14.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.129 -0.487 . . . . 74.439999999999998 111.158 179.863 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' M' M ' 36' ' ' TRP . . . . . . . . . . . . . 29.9 m0 -58.85 -39.16 80.48 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.139 -0.482 . . . . 75.329999999999998 110.933 179.965 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' M' M ' 37' ' ' ALA . . . . . . . . . . . . . . . -63.9 -18.59 64.36 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.216 -0.447 . . . . 62.340000000000003 111.117 179.88 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' M' M ' 38' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -73.94 -17.9 60.96 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.185 -0.461 . . . . 61.140000000000001 110.848 -179.742 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' M' M ' 39' ' ' ARG . . . . . . . . . . . . . 50.7 mtp180 -55.55 -31.4 62.11 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.131 -0.486 . . . . 72.129999999999995 110.85 -179.944 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' M' M ' 40' ' ' GLU . . . . . . . . . . . . . 14.3 tp10 -79.94 -46.53 16.55 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.156 -0.474 . . . . 74.209999999999994 110.89 -179.934 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' M' M ' 41' ' ' LEU . . . . . . . . . . . . . 11.9 mt -61.4 116.09 4.39 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.14 -0.482 . . . . 74.150000000000006 110.89 -179.936 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' M' M ' 42' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -53.94 160.82 1.35 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.158 -0.474 . . . . 73.150000000000006 110.9 179.923 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' M' M ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.342 0 CA-C-N 116.169 -0.469 . . . . 74.530000000000001 110.906 -179.923 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 241' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 262' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 301' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 322' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.139 0 CA-C-O 120.794 0.331 . . . . 62.109999999999999 111.083 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -72.57 79.04 1.07 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.236 -0.438 . . . . 55.409999999999997 110.869 179.968 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 4.6 tt0 -105.93 36.44 2.56 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.2 -0.454 . . . . 74.340000000000003 110.948 -179.945 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -102.25 109.46 21.14 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.148 -0.478 . . . . 75.319999999999993 110.88 -179.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 5.5 p -100.38 176.71 5.27 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.185 -0.461 . . . . 72.019999999999996 111.119 179.937 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 20.6 tt0 -58.04 -36.23 72.45 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.217 -0.447 . . . . 74.430000000000007 110.919 -179.982 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 65.3 tt0 -67.66 -35.81 79.56 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.131 -0.486 . . . . 72.430000000000007 110.88 -179.949 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 8.5 tp-100 -77.98 -41.43 36.06 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.199 -0.455 . . . . 72.230000000000004 110.942 -179.964 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 59.2 mt -70.5 -43.33 78.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.238 -0.437 . . . . 73.319999999999993 111.116 179.932 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -52.11 -29.62 22.54 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.21 -0.45 . . . . 55.549999999999997 111.078 179.847 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 43.7 mm-40 -74.66 -52.0 12.84 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.28 -0.418 . . . . 73.129999999999995 110.882 -179.952 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 24.2 m-85 -61.91 -46.04 91.08 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.153 -0.476 . . . . 75.310000000000002 110.845 -179.88 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 34.1 ttmt -55.33 -26.98 44.07 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.117 -0.492 . . . . 74.310000000000002 110.95 179.962 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 56.4 tt0 -72.61 -38.72 67.72 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.222 -0.445 . . . . 74.420000000000002 110.888 179.927 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -63.77 -43.4 96.5 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.181 -0.463 . . . . 74.019999999999996 111.103 179.942 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 67.1 t80 -57.12 -53.7 55.06 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.197 -0.456 . . . . 74.5 110.904 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 46.9 m -52.35 -34.24 46.53 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.133 -0.485 . . . . 74.129999999999995 110.871 -179.795 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 16.6 tp -62.43 -46.68 87.46 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.09 -0.505 . . . . 70.230000000000004 110.913 179.996 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 46.2 m-85 -71.95 -25.98 62.1 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.2 -0.454 . . . . 72.439999999999998 110.877 179.933 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 13.9 t0 -82.69 98.54 9.11 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.138 -0.483 . . . . 72.310000000000002 110.852 179.995 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 15.8 ttmm -67.88 -51.76 44.37 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.168 -0.469 . . . . 72.239999999999995 110.863 -179.989 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 29.9 p-10 -79.57 -10.1 59.74 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.217 -0.447 . . . . 72.239999999999995 110.884 179.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 51.96 44.32 55.99 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.764 -0.732 . . . . 74.219999999999999 112.454 -179.938 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 17.2 p-10 -88.5 -15.72 34.55 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.813 0.339 . . . . 74.329999999999998 110.851 -179.989 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 102.24 17.09 21.19 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.716 -0.754 . . . . 64.109999999999999 112.521 -179.919 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -154.58 131.43 10.81 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.76 0.315 . . . . 65.099999999999994 111.133 -179.85 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 23.3 mt -92.51 111.67 24.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.256 -0.429 . . . . 73.349999999999994 111.128 179.941 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 19.6 p -97.78 178.21 5.22 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.2 -0.454 . . . . 72.319999999999993 111.093 -179.989 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 3.0 p -62.77 -27.19 69.12 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.205 -0.452 . . . . 73.239999999999995 111.184 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 7.8 mmmm -69.78 -50.09 46.56 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.173 -0.467 . . . . 74.239999999999995 110.899 179.93 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 -74.24 -32.71 63.08 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.214 -0.448 . . . . 74.120000000000005 110.899 179.95 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -74.14 -41.26 61.82 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.145 -0.479 . . . . 75.510000000000005 110.912 179.996 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -70.67 -34.43 66.93 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.801 -0.714 . . . . 75.219999999999999 112.5 179.887 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 96.7 m -67.43 -59.88 3.02 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.784 0.326 . . . . 72.420000000000002 111.136 -179.809 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 66.7 t -52.94 -52.11 31.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.194 -0.457 . . . . 72.329999999999998 111.132 179.903 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 6.3 ttt -51.93 -29.97 22.5 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.179 -0.464 . . . . 74.409999999999997 110.902 179.899 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 3.7 tmm_? -72.65 -52.85 13.64 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.17 -0.468 . . . . 71.109999999999999 110.884 -179.971 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 4.6 t -58.52 -25.69 62.69 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.23 -0.441 . . . . 74.329999999999998 110.907 -179.811 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 61.2 mt -78.15 -13.88 59.69 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.101 -0.5 . . . . 73.510000000000005 110.936 179.964 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 101.5 23.88 9.19 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.778 -0.725 . . . . 62.439999999999998 112.518 179.936 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 8.3 tp-100 -124.59 129.35 50.4 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.785 0.326 . . . . 72.530000000000001 110.931 -179.904 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 61.1 t30 -109.71 82.46 2.31 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.591 0.71 . . . . 74.230000000000004 110.902 -179.957 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.8 167.97 22.95 Favored 'Trans proline' 0 C--O 1.232 0.221 0 C-N-CA 122.72 2.28 . . . . 74.209999999999994 112.324 179.988 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 20.5 p -112.53 155.47 24.27 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.249 -0.432 . . . . 62.219999999999999 111.195 -179.993 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -51.91 -40.51 60.84 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.227 -0.442 . . . . 73.230000000000004 110.886 179.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.44 -31.46 63.83 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.145 -0.48 . . . . 73.049999999999997 111.112 179.973 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -70.76 -49.71 43.82 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.217 -0.447 . . . . 73.329999999999998 110.873 -179.933 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 13.9 mt -55.07 -51.0 67.73 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.175 -0.466 . . . . 72.329999999999998 110.926 -179.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 15.4 tp60 -59.93 -28.39 67.58 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.171 -0.468 . . . . 75.25 110.906 179.928 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 38.3 t0 -74.63 -49.96 19.55 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.22 -0.446 . . . . 73.25 110.865 -179.996 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 14.6 ptm -66.92 -42.49 85.29 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.212 -0.449 . . . . 73.209999999999994 110.894 179.976 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 97.1 mt -65.83 -38.11 81.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.149 -0.478 . . . . 65.530000000000001 111.12 179.97 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 33.6 m-20 -62.28 -36.17 81.25 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.18 -0.464 . . . . 65.150000000000006 110.847 179.959 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 24.9 mm-40 -63.62 -29.73 70.94 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.216 -0.447 . . . . 72.25 110.9 -179.963 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 9.7 m -105.34 12.68 8.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.151 -0.477 . . . . 74.439999999999998 111.114 179.967 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 30.7 t0 -90.01 98.73 11.94 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.232 -0.44 . . . . 73.0 110.857 179.953 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.34 -44.71 10.59 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.21 -0.45 . . . . 54.399999999999999 111.1 179.957 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 41.2 p30 -82.93 -0.2 47.43 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.219 -0.446 . . . . 74.230000000000004 110.837 -179.999 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 55.2 55.34 28.78 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.731 -0.747 . . . . 62.399999999999999 112.477 -179.927 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 48.7 p-10 -114.64 -15.74 11.92 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.891 0.376 . . . . 73.409999999999997 110.867 -179.895 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 92.71 19.14 38.39 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.799 -0.715 . . . . 64.510000000000005 112.478 179.96 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 26.7 p -146.52 165.91 28.04 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.749 0.309 . . . . 64.040000000000006 111.148 -179.881 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 18.5 mt -96.23 109.43 22.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.219 -0.446 . . . . 72.329999999999998 111.132 179.915 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -74.04 -177.81 3.06 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.205 -0.452 . . . . 71.510000000000005 110.901 179.839 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.518 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 2.5 t80 -61.6 -58.35 18.98 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.636 0.731 . . . . 75.230000000000004 110.891 -179.886 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . 0.518 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 53.9 Cg_endo -69.78 -29.73 23.3 Favored 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.668 2.245 . . . . 73.519999999999996 112.299 -179.991 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 80.6 mt-10 -58.57 -40.02 81.95 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.268 -0.424 . . . . 73.019999999999996 110.868 -179.963 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 50.4 t80 -73.79 -36.05 65.0 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.119 -0.491 . . . . 72.400000000000006 110.894 -179.923 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 16.4 tp -68.84 -53.84 19.12 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.177 -0.465 . . . . 73.25 110.932 -179.976 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 14.1 t -52.9 -28.45 23.34 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.214 -0.448 . . . . 75.430000000000007 111.154 179.964 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 39.6 ttp -65.24 -42.46 93.35 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.231 -0.441 . . . . 71.430000000000007 110.873 179.876 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -71.97 -35.75 69.61 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.218 -0.447 . . . . 72.450000000000003 110.848 179.975 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -74.8 -29.62 61.15 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.237 -0.438 . . . . 75.5 111.078 179.926 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 16.6 ttm180 -64.84 -25.59 67.97 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.209 -0.45 . . . . 72.519999999999996 110.884 -179.887 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -51.96 -30.48 24.92 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.186 -0.461 . . . . 63.409999999999997 110.864 179.95 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 41.3 mtt -51.94 -41.56 62.14 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.272 -0.422 . . . . 74.510000000000005 110.893 179.886 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 7.1 mtmm -146.93 126.83 13.55 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.238 -0.437 . . . . 70.219999999999999 110.895 179.934 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -150.09 -74.68 0.16 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.215 -0.448 . . . . 75.150000000000006 110.857 179.859 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 13.5 t -112.4 161.96 16.1 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.162 -0.472 . . . . 75.530000000000001 111.154 -179.917 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 9.2 t0 71.66 2.64 4.36 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.244 -0.435 . . . . 72.409999999999997 110.819 179.901 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 70.9 m -80.14 -39.58 29.14 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.215 -0.448 . . . . 63.450000000000003 110.866 -179.778 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -58.81 -38.49 78.72 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.17 -0.468 . . . . 73.310000000000002 110.853 -179.895 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -58.22 -44.15 88.06 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.167 -0.47 . . . . 71.140000000000001 110.865 -179.931 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -65.69 -32.99 74.85 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.207 -0.451 . . . . 74.450000000000003 110.895 -179.912 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 51.4 mt -68.19 -50.96 53.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.11 -0.495 . . . . 74.140000000000001 111.181 179.928 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 51.2 ttt180 -66.04 -33.5 75.94 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.131 -0.486 . . . . 75.209999999999994 110.847 179.969 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -76.41 -34.94 58.8 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.241 -0.436 . . . . 71.219999999999999 110.878 -179.912 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -76.62 -34.49 58.35 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.149 -0.478 . . . . 63.020000000000003 111.086 179.94 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -61.57 -48.63 80.08 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.216 -0.447 . . . . 73.329999999999998 110.879 -179.936 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 12.9 ptm180 -60.76 -25.93 66.85 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.168 -0.469 . . . . 75.329999999999998 110.865 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 94.0 t -75.58 -51.21 21.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.234 -0.439 . . . . 74.239999999999995 111.136 179.98 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 8.9 m-85 -70.79 -26.61 63.4 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.184 -0.462 . . . . 73.409999999999997 110.882 -179.983 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 33.1 t0 -76.52 88.91 3.26 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.157 -0.474 . . . . 71.129999999999995 110.864 179.954 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 59.4 mmtt -75.31 -51.04 14.17 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.203 -0.453 . . . . 72.329999999999998 110.914 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 31.2 p30 -72.58 -9.08 58.15 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.233 -0.439 . . . . 72.319999999999993 110.882 179.857 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 59.96 27.72 65.06 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.765 -0.731 . . . . 73.420000000000002 112.527 -179.9 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 44.7 p-10 -82.88 -16.12 48.79 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.899 0.38 . . . . 74.5 110.909 -179.878 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 89.08 18.72 53.22 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.752 -0.737 . . . . 73.230000000000004 112.491 179.981 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 20.2 m-85 -137.51 152.39 49.44 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.824 0.345 . . . . 74.230000000000004 110.945 -179.798 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 65.2 mt -122.63 114.64 43.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.135 -0.484 . . . . 74.340000000000003 111.152 179.916 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 6.8 p -107.19 165.43 11.37 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.208 -0.451 . . . . 53.310000000000002 110.87 -179.926 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -51.85 -29.83 21.21 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.136 -0.484 . . . . 75.239999999999995 111.11 179.904 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -68.92 -43.11 75.83 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.191 -0.459 . . . . 75.430000000000007 111.096 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 83.5 mt-10 -76.8 -49.4 15.95 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.185 -0.461 . . . . 55.549999999999997 110.916 -179.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 24.3 tp -53.31 -47.62 69.1 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.187 -0.46 . . . . 75.150000000000006 110.891 -179.981 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 46.9 ttp180 -53.02 -31.31 40.45 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.219 -0.446 . . . . 75.409999999999997 110.887 179.954 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 63.0 t60 -69.27 -34.41 74.72 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.168 -0.469 . . . . 74.140000000000001 110.889 179.977 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 45.3 t -70.0 -32.24 50.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.238 -0.437 . . . . 75.420000000000002 111.113 -179.989 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 7.8 mmt -73.09 -43.75 61.36 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.158 -0.473 . . . . 74.510000000000005 110.844 179.931 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -54.99 -41.13 70.86 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.243 -0.435 . . . . 74.129999999999995 111.145 -179.907 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 61.0 m-20 -71.57 -32.24 67.86 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.203 -0.453 . . . . 72.409999999999997 110.88 179.997 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 5.0 mt -70.75 -25.75 63.05 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.148 -0.478 . . . . 75.439999999999998 110.923 179.959 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 101.07 32.42 5.3 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.787 -0.72 . . . . 65.209999999999994 112.454 179.88 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -113.75 109.97 19.42 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.896 0.379 . . . . 72.25 110.875 -179.861 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -66.61 108.08 2.32 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.159 -0.473 . . . . 74.200000000000003 110.876 179.984 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 10.4 mt -143.63 160.38 40.77 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.218 -0.446 . . . . 75.239999999999995 110.954 179.894 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 31.9 p -118.86 177.01 5.01 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.217 -0.447 . . . . 75.340000000000003 111.139 179.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -57.05 -43.74 82.3 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.245 -0.434 . . . . 65.299999999999997 110.845 179.938 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -65.0 -33.44 76.06 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.212 -0.449 . . . . 71.5 110.845 -179.87 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -70.12 -43.92 70.0 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.143 -0.48 . . . . 75.530000000000001 110.926 -179.974 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 48.6 t -59.19 -31.94 47.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.155 -0.475 . . . . 72.319999999999993 111.114 179.976 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 11.7 t0 -52.01 -42.77 63.28 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.226 -0.443 . . . . 74.040000000000006 110.856 179.916 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -55.76 -32.65 63.61 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.179 -0.464 . . . . 74.340000000000003 110.895 -179.909 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 30.8 mtp -76.05 -59.17 2.88 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.164 -0.471 . . . . 71.109999999999999 110.882 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 36.0 mm -53.92 -35.73 28.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.218 -0.446 . . . . 73.5 111.12 179.931 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 24.0 ttm180 -63.44 -31.85 73.13 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.178 -0.464 . . . . 75.239999999999995 110.898 179.944 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 21.0 tp10 -74.75 -52.38 11.68 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.161 -0.472 . . . . 72.209999999999994 110.842 -179.901 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -65.21 -34.41 78.3 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.159 -0.473 . . . . 75.329999999999998 111.088 179.982 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 49.4 t0 -68.42 86.74 0.3 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.217 -0.447 . . . . 52.130000000000003 110.882 179.968 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 60.6 mt -79.81 -46.15 22.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.172 -0.467 . . . . 71.530000000000001 111.126 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 21.2 p30 -72.78 -8.7 56.7 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.151 -0.477 . . . . 52.130000000000003 110.874 179.864 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 62.7 42.97 99.61 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.692 -0.766 . . . . 70.200000000000003 112.505 -179.933 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 34.6 p-10 -88.05 -15.98 34.84 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.825 0.345 . . . . 73.540000000000006 110.877 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 103.98 2.41 45.58 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.761 -0.733 . . . . 73.129999999999995 112.501 -179.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -149.15 172.26 15.11 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.829 0.347 . . . . 74.140000000000001 110.939 -179.88 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 136' ' ' VAL . . . . . . . . . . . . . 95.6 t -107.8 111.06 34.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.204 -0.453 . . . . 74.200000000000003 111.127 179.939 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 44.2 p-10 -92.82 165.95 12.66 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.153 -0.476 . . . . 73.239999999999995 110.88 -179.967 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 58.9 t80 -51.97 -46.47 64.84 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.207 -0.451 . . . . 75.540000000000006 110.905 -179.906 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 -51.99 -40.89 61.65 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.113 -0.494 . . . . 72.150000000000006 110.867 -179.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 20.7 mt-10 -78.34 -39.81 38.36 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.2 -0.455 . . . . 73.409999999999997 110.876 -179.926 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 52.4 t80 -61.17 -38.66 87.29 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.15 -0.477 . . . . 75.439999999999998 110.87 -179.888 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 93.8 t -71.26 -37.95 68.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.119 -0.491 . . . . 74.239999999999995 111.11 179.961 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 3.4 tp-100 -71.56 -31.25 66.79 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.185 -0.461 . . . . 73.310000000000002 110.895 -179.955 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 9.0 tpt -74.7 -42.43 58.39 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.193 -0.458 . . . . 73.540000000000006 110.867 179.964 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 9.6 ttm -79.34 -26.07 42.19 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.236 -0.438 . . . . 71.420000000000002 110.875 179.967 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 2.6 m -110.75 21.26 16.73 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.23 -0.441 . . . . 70.420000000000002 111.14 -179.924 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -60.47 -170.51 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.245 -0.434 . . . . 75.430000000000007 111.086 179.894 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 7.3 mmmm . . . . . 0 C--N 1.329 -0.32 0 CA-C-N 116.192 -0.458 . . . . 73.450000000000003 110.902 179.991 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' M' M ' 8' ' ' LEU . . . . . . . . . . . . . 9.3 mp . . . . . 0 C--O 1.231 0.08 0 CA-C-O 120.8 0.333 . . . . 73.209999999999994 110.91 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' M' M ' 9' ' ' SER . . . . . . . . . . . . . 12.2 p -155.92 177.82 10.98 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.151 -0.477 . . . . 71.430000000000007 110.821 -179.971 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' M' M ' 10' ' ' GLY . . . . . . . . . . . . . . . 161.87 146.06 4.53 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.782 -0.723 . . . . 64.530000000000001 112.521 -179.981 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' M' M ' 11' ' ' GLY . . . . . . . . . . . . . . . 100.59 -33.69 6.18 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.744 -0.741 . . . . 72.099999999999994 112.465 -179.964 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' M' M ' 12' ' ' GLU . . . . . . . . . . . . . 54.4 mt-10 -87.27 -179.14 6.36 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.886 0.375 . . . . 74.430000000000007 110.869 -179.865 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' M' M ' 13' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -87.79 75.81 8.86 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.133 -0.485 . . . . 73.409999999999997 110.91 -179.965 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' M' M ' 14' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -102.87 26.11 8.5 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.152 -0.476 . . . . 75.329999999999998 110.891 179.794 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' M' M ' 15' ' ' LYS . . . . . . . . . . . . . 60.9 mttp -66.17 -57.16 8.23 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.223 -0.444 . . . . 73.230000000000004 110.894 179.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' M' M ' 16' ' ' TRP . . . . . . . . . . . . . 19.7 m95 -54.34 -39.31 66.96 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.244 -0.434 . . . . 71.450000000000003 110.862 179.983 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' M' M ' 17' ' ' GLU . . . . . . . . . . . . . 41.0 tp10 -56.45 -26.81 54.97 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.243 -0.435 . . . . 74.439999999999998 110.883 -179.974 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' M' M ' 18' ' ' LYS . . . . . . . . . . . . . 6.9 ttpm? -78.61 -25.87 45.21 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.171 -0.468 . . . . 74.349999999999994 110.897 179.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' M' M ' 19' ' ' ILE . . . . . . . . . . . . . 29.6 mt -89.88 -25.22 5.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.187 -0.46 . . . . 73.5 111.14 179.874 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' M' M ' 20' ' ' ARG . . . . . . . . . . . . . 22.5 ttt180 -54.37 -40.21 67.91 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.174 -0.466 . . . . 74.400000000000006 110.903 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' M' M ' 21' ' ' LEU . . . . . . . . . . . . . 4.1 mt 52.91 -170.33 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.164 -0.471 . . . . 74.150000000000006 110.942 -179.997 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' M' M ' 22' ' ' ARG . . . . . . . . . . . . . 3.0 mmt180 60.01 79.39 0.3 Allowed Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.595 0.712 . . . . 73.310000000000002 110.914 179.952 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' M' M ' 23' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.76 -28.0 25.79 Favored 'Trans proline' 0 C--N 1.342 0.204 0 C-N-CA 122.705 2.27 . . . . 72.340000000000003 112.358 -179.967 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' M' M ' 24' ' ' GLY . . . . . . . . . . . . . . . -150.68 169.07 30.52 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.78 -0.724 . . . . 43.030000000000001 112.489 179.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' M' M ' 25' ' ' GLY . . . . . . . . . . . . . . . -105.12 -118.96 4.54 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.725 -0.75 . . . . 62.340000000000003 112.445 -179.871 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' M' M ' 26' ' ' LYS . . . . . . . . . . . . . 6.0 ttpm? -148.18 -74.23 0.19 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.842 0.353 . . . . 74.340000000000003 110.891 -179.988 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' M' M ' 27' ' ' LYS . . . . . . . . . . . . . 17.0 ttpt -176.25 133.19 0.24 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.253 -0.43 . . . . 74.430000000000007 110.902 179.851 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' M' M ' 28' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -176.36 52.63 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.214 -0.448 . . . . 75.129999999999995 110.88 179.941 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' M' M ' 29' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -154.88 -47.08 0.08 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.216 -0.447 . . . . 74.010000000000005 110.969 -179.894 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' M' M ' 30' ' ' LYS . . . . . . . . . . . . . 3.0 ttmm 61.15 27.35 17.15 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.092 -0.504 . . . . 74.430000000000007 110.892 179.888 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' M' M ' 31' ' ' LEU . . . . . . . . . . . . . 9.5 tp -127.33 -52.28 1.39 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.196 -0.456 . . . . 75.439999999999998 110.933 179.926 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' M' M ' 32' ' ' LYS . . . . . . . . . . . . . 3.2 ttpp -47.65 -47.08 29.41 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.212 -0.449 . . . . 75.109999999999999 110.918 179.792 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' M' M ' 33' ' ' HIS . . . . . . . . . . . . . 74.8 t60 -50.45 -39.87 48.93 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.201 -0.454 . . . . 70.109999999999999 110.838 179.924 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' M' M ' 34' ' ' ILE . . . . . . . . . . . . . 50.1 mt -50.73 -39.27 18.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.236 -0.438 . . . . 75.420000000000002 111.123 -180.0 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' M' M ' 35' ' ' VAL . . . . . . . . . . . . . 61.1 t -49.27 -39.93 13.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.194 -0.457 . . . . 75.519999999999996 111.098 179.895 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' M' M ' 36' ' ' TRP . . . . . . . . . . . . . 22.8 m0 -59.02 -39.5 82.12 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.168 -0.469 . . . . 74.040000000000006 110.95 179.958 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' M' M ' 37' ' ' ALA . . . . . . . . . . . . . . . -63.71 -18.69 64.28 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.205 -0.452 . . . . 74.25 111.069 179.874 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' M' M ' 38' ' ' SER . . . . . . . . . . . . . 1.2 m -69.3 -17.96 63.78 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.24 -0.436 . . . . 72.5 110.871 -179.769 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' M' M ' 39' ' ' ARG . . . . . . . . . . . . . 26.4 ptt180 -56.11 -25.38 45.64 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.107 -0.497 . . . . 74.150000000000006 110.877 -179.916 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' M' M ' 40' ' ' GLU . . . . . . . . . . . . . 41.6 mm-40 -88.1 -47.99 8.07 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.188 -0.46 . . . . 54.43 110.914 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' M' M ' 41' ' ' LEU . . . . . . . . . . . . . 12.9 mt -60.39 168.4 2.1 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.165 -0.47 . . . . 75.049999999999997 110.97 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' M' M ' 42' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -156.95 -48.65 0.07 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.174 -0.466 . . . . 75.109999999999999 110.896 179.945 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' M' M ' 43' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.321 0 CA-C-N 116.153 -0.476 . . . . 74.230000000000004 110.859 -179.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 241' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 262' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 301' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 322' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.085 0 CA-C-O 120.806 0.336 . . . . 60.200000000000003 111.1 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -105.35 -175.67 2.86 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.197 -0.456 . . . . 73.25 110.845 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 31.8 mm-40 -74.23 -74.51 0.19 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.202 -0.454 . . . . 73.129999999999995 110.893 -179.879 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 7.7 mt -134.18 149.96 51.06 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.155 -0.475 . . . . 74.420000000000002 110.932 179.998 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 31.2 p -119.01 177.73 4.76 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.202 -0.454 . . . . 72.430000000000007 111.151 179.924 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 11.9 tm-20 -56.46 -30.09 62.48 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.231 -0.44 . . . . 73.420000000000002 110.87 -179.949 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 58.2 tt0 -67.47 -39.92 85.31 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.164 -0.471 . . . . 74.120000000000005 110.879 -179.931 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 8.0 tp60 -77.78 -36.78 50.09 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.165 -0.47 . . . . 71.030000000000001 110.908 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 59.4 mt -72.56 -38.39 59.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.199 -0.455 . . . . 75.209999999999994 111.088 179.989 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -65.91 -27.02 67.88 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.228 -0.442 . . . . 61.039999999999999 111.137 179.807 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 20.6 mm-40 -74.83 -44.75 47.56 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.173 -0.467 . . . . 65.230000000000004 110.9 -179.933 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 23.8 m-85 -75.26 -45.81 37.68 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.157 -0.474 . . . . 63.229999999999997 110.853 -179.913 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 27.0 ttmt -56.36 -44.53 80.2 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.149 -0.478 . . . . 75.239999999999995 110.888 179.976 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -52.99 -32.65 47.61 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.202 -0.454 . . . . 72.400000000000006 110.84 -179.993 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -67.51 -42.2 83.23 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.193 -0.458 . . . . 72.040000000000006 111.109 179.916 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 66.6 t80 -56.07 -53.51 56.18 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.199 -0.455 . . . . 74.25 110.899 -179.914 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 70.9 m -55.85 -27.21 50.54 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.141 -0.481 . . . . 72.329999999999998 110.855 -179.796 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 15.5 tp -67.77 -40.25 84.04 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.182 -0.463 . . . . 74.5 110.947 179.964 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 59.5 m-85 -82.43 -34.48 28.2 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.228 -0.442 . . . . 75.109999999999999 110.853 179.93 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 11.0 t0 -69.47 98.52 1.12 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.192 -0.458 . . . . 65.310000000000002 110.859 -179.999 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 45.4 mmtt -72.09 -56.14 6.12 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.169 -0.469 . . . . 72.129999999999995 110.869 -179.978 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 26.5 p-10 -73.94 -10.01 59.22 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.2 -0.455 . . . . 53.409999999999997 110.876 179.893 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 51.99 44.6 56.41 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.762 -0.732 . . . . 74.129999999999995 112.529 -179.9 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 26.5 p-10 -88.51 -15.77 34.41 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.878 0.371 . . . . 72.530000000000001 110.89 -179.979 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 104.67 -11.72 50.08 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.74 -0.743 . . . . 72.019999999999996 112.47 -179.953 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 20.7 p -131.04 130.68 43.58 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.715 0.293 . . . . 74.430000000000007 111.166 -179.851 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 21.2 mt -90.47 130.84 39.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.292 -0.413 . . . . 70.530000000000001 111.096 179.919 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 29.8 p -108.75 -176.83 3.15 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.188 -0.46 . . . . 73.129999999999995 111.141 179.963 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 7.6 p -65.61 -41.5 92.69 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.247 -0.433 . . . . 73.209999999999994 111.126 -179.985 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 79.8 mttt -68.23 -50.15 55.91 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.206 -0.452 . . . . 73.150000000000006 110.902 179.935 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 27.4 mt-10 -56.36 -32.65 64.94 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.187 -0.461 . . . . 74.310000000000002 110.882 179.992 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -73.13 -43.14 62.07 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.156 -0.475 . . . . 63.039999999999999 110.926 179.988 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -69.73 -27.86 72.77 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.742 -0.742 . . . . 73.219999999999999 112.448 179.933 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 46.6 m -64.68 -59.51 4.18 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.841 0.353 . . . . 74.129999999999995 111.177 -179.896 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 99.9 t -57.38 -50.35 77.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.233 -0.439 . . . . 72.129999999999995 111.169 179.864 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 1.9 ttt -55.08 -30.42 59.63 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.166 -0.47 . . . . 75.109999999999999 110.907 179.88 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 23.9 ttm180 -60.1 -50.67 72.8 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.223 -0.444 . . . . 73.530000000000001 110.9 -179.96 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.6 t -61.34 -26.17 67.64 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.16 -0.473 . . . . 63.039999999999999 110.853 -179.751 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 58.2 mt -73.84 -20.5 60.42 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.096 -0.502 . . . . 74.040000000000006 110.93 179.963 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 101.5 29.62 6.21 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.715 -0.755 . . . . 75.230000000000004 112.467 179.886 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 10.5 mm-40 -127.46 133.97 49.87 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.796 0.331 . . . . 73.120000000000005 110.918 -179.882 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 10.7 t-20 -109.27 86.24 4.03 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.609 0.718 . . . . 75.420000000000002 110.875 -179.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.78 167.89 23.16 Favored 'Trans proline' 0 C--O 1.231 0.167 0 C-N-CA 122.709 2.272 . . . . 75.030000000000001 112.306 179.934 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 19.3 p -111.79 156.49 21.89 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.187 -0.461 . . . . 61.420000000000002 111.152 179.997 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 12.3 tp10 -51.97 -40.81 61.47 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.244 -0.435 . . . . 74.230000000000004 110.882 179.973 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.32 -39.37 65.33 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.159 -0.473 . . . . 73.010000000000005 111.109 179.943 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -60.47 -52.58 64.58 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.258 -0.428 . . . . 72.420000000000002 110.886 -179.924 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 19.7 mt -55.27 -48.52 73.89 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.163 -0.471 . . . . 74.219999999999999 110.89 -179.956 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.84 -41.94 71.33 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.196 -0.456 . . . . 73.219999999999999 110.894 179.977 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 51.0 t0 -57.99 -43.2 86.45 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.175 -0.466 . . . . 72.040000000000006 110.878 179.949 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 5.8 mtp -62.9 -55.36 26.75 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.205 -0.452 . . . . 73.25 110.873 179.989 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 65.5 mt -53.24 -53.66 22.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.201 -0.454 . . . . 75.230000000000004 111.144 179.95 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 6.5 m-20 -61.73 -37.67 85.06 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.203 -0.453 . . . . 71.219999999999999 110.88 179.936 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 -60.02 -33.16 71.64 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.163 -0.471 . . . . 72.310000000000002 110.914 179.986 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 32.8 m -109.97 20.2 6.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.126 -0.488 . . . . 73.049999999999997 111.141 179.95 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 29.3 t0 -90.11 99.15 12.22 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.157 -0.474 . . . . 63.299999999999997 110.83 179.947 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.35 -40.19 13.76 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.163 -0.471 . . . . 63.43 111.071 179.956 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 13.0 p-10 -86.64 -0.12 55.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.235 -0.439 . . . . 74.420000000000002 110.859 179.981 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 52.46 56.81 15.8 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.738 -0.744 . . . . 74.109999999999999 112.504 -179.911 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 52.1 p-10 -114.48 -15.89 11.99 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.877 0.37 . . . . 74.519999999999996 110.921 -179.93 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 91.65 17.79 47.38 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.695 -0.764 . . . . 72.25 112.445 179.981 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 25.1 p -150.49 162.38 40.71 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.721 0.296 . . . . 75.239999999999995 111.168 -179.814 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 20.3 mt -97.86 109.39 23.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.242 -0.435 . . . . 74.109999999999999 111.121 179.941 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -75.84 -172.69 2.01 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.218 -0.447 . . . . 73.430000000000007 110.864 179.878 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.521 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 2.5 t80 -64.91 -58.15 13.77 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.644 0.735 . . . . 74.540000000000006 110.909 -179.948 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . 0.521 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 54.3 Cg_endo -69.71 -27.83 26.25 Favored 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.669 2.246 . . . . 72.019999999999996 112.364 179.977 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 14.0 mt-10 -59.75 -41.06 90.13 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.221 -0.445 . . . . 73.239999999999995 110.864 -179.939 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 24.0 t80 -73.99 -36.11 64.49 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.164 -0.471 . . . . 74.430000000000007 110.924 -179.982 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 24.0 tp -68.14 -53.89 21.92 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.141 -0.481 . . . . 74.420000000000002 110.921 -179.987 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 14.8 t -54.92 -30.85 59.47 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.2 -0.455 . . . . 70.530000000000001 111.124 179.972 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 44.1 ttp -58.94 -38.3 78.69 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.216 -0.447 . . . . 73.420000000000002 110.86 179.919 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -75.65 -36.66 60.09 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.214 -0.448 . . . . 72.099999999999994 110.884 179.965 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -60.14 -30.75 69.51 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.224 -0.444 . . . . 70.129999999999995 111.085 179.92 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 14.1 tpp180 -63.58 -19.88 65.19 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.248 -0.433 . . . . 75.140000000000001 110.912 -179.974 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -51.71 -32.09 28.85 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.197 -0.456 . . . . 74.340000000000003 110.859 -179.972 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -89.95 -25.04 21.11 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.197 -0.456 . . . . 73.030000000000001 110.9 179.895 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 52.6 mttt -71.29 -74.76 0.14 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.207 -0.451 . . . . 73.329999999999998 110.867 179.934 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -179.35 108.14 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.207 -0.451 . . . . 65.540000000000006 110.896 179.899 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -150.8 68.03 0.94 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.22 -0.446 . . . . 74.519999999999996 111.148 -179.864 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -117.46 -28.63 6.04 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.239 -0.437 . . . . 74.209999999999994 110.862 179.906 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 16.9 m -56.85 -27.64 60.59 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.215 -0.448 . . . . 70.510000000000005 110.838 -179.764 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -96.85 -26.53 15.06 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.141 -0.481 . . . . 74.030000000000001 110.879 -179.942 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 11.8 tm-20 -75.52 -34.19 60.78 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.163 -0.471 . . . . 75.25 110.866 -179.923 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 20.3 tp10 -66.71 -28.46 68.45 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.171 -0.468 . . . . 71.439999999999998 110.911 -179.94 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 76.5 mt -74.55 -48.71 33.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.128 -0.487 . . . . 64.209999999999994 111.11 179.98 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 25.9 ttt85 -71.44 -42.27 68.43 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.138 -0.483 . . . . 73.439999999999998 110.859 179.962 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 18.0 tt0 -62.31 -56.93 13.67 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.215 -0.448 . . . . 74.439999999999998 110.89 -179.896 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -53.35 -51.03 63.75 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.152 -0.476 . . . . 74.209999999999994 111.082 179.935 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 17.1 t80 -53.16 -43.41 67.03 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.2 -0.455 . . . . 73.140000000000001 110.933 -179.928 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 59.6 ttp180 -69.19 -34.29 74.69 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.127 -0.488 . . . . 72.230000000000004 110.846 -179.886 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 96.1 t -66.07 -40.73 88.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.139 -0.482 . . . . 74.340000000000003 111.167 179.967 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 8.3 m-85 -76.81 -31.92 57.27 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.129 -0.487 . . . . 75.129999999999995 110.843 -179.972 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 21.5 t0 -71.29 85.4 0.79 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.158 -0.473 . . . . 62.020000000000003 110.869 -180.0 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 11.5 ptpt -78.72 -40.58 33.25 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.175 -0.466 . . . . 74.329999999999998 110.876 -179.995 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 55.2 p-10 -75.01 -9.17 58.28 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.202 -0.454 . . . . 60.43 110.842 179.883 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 59.55 26.81 62.72 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.74 -0.743 . . . . 71.340000000000003 112.504 -179.885 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 35.8 p-10 -84.22 -16.13 44.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.879 0.371 . . . . 74.019999999999996 110.888 -179.901 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 80.98 18.26 70.25 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.744 -0.741 . . . . 70.549999999999997 112.482 -179.996 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 20.7 m-85 -140.83 142.24 34.61 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.84 0.352 . . . . 72.140000000000001 110.948 -179.789 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 62.3 mt -103.48 126.44 57.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.172 -0.467 . . . . 75.109999999999999 111.12 179.913 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 93.0 p -107.28 -175.63 2.84 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.193 -0.458 . . . . 74.150000000000006 110.896 -179.942 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -73.27 -31.56 64.16 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.115 -0.493 . . . . 74.209999999999994 111.088 179.928 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -71.07 -47.08 60.41 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.234 -0.439 . . . . 75.230000000000004 111.087 179.935 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 69.9 mt-10 -69.16 -44.02 73.12 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.254 -0.43 . . . . 75.510000000000005 110.917 -179.914 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 35.8 tp -53.42 -42.32 66.94 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.104 -0.498 . . . . 75.430000000000007 110.928 -179.989 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 8.9 ttt-85 -63.98 -49.33 72.94 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.223 -0.444 . . . . 75.5 110.858 179.975 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 18.9 t60 -54.22 -34.39 60.52 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.212 -0.449 . . . . 63.299999999999997 110.877 179.951 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 95.2 t -73.34 -29.98 29.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.194 -0.457 . . . . 71.209999999999994 111.098 179.995 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 44.4 tpp -73.29 -53.76 10.06 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.226 -0.443 . . . . 63.140000000000001 110.884 179.939 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 2.1 t -51.75 -30.18 21.66 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.198 -0.455 . . . . 75.439999999999998 111.13 -179.923 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 6.7 m120 -65.06 -37.45 87.6 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.2 -0.455 . . . . 75.400000000000006 110.932 179.979 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 17.3 mt -72.12 -9.72 58.8 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.182 -0.463 . . . . 71.0 110.916 179.919 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 101.08 29.18 6.53 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.736 -0.745 . . . . 74.439999999999998 112.503 179.923 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 12.4 tp10 -133.01 110.06 9.98 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.953 0.406 . . . . 72.439999999999998 110.885 -179.907 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 31.0 tttt -85.69 120.42 27.1 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.133 -0.485 . . . . 75.319999999999993 110.879 179.96 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 61.1 mt -124.54 153.58 41.9 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.191 -0.459 . . . . 74.319999999999993 110.921 179.895 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 45.5 p -89.55 162.83 15.47 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.18 -0.464 . . . . 65.219999999999999 111.154 179.964 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 94.7 m-20 -53.56 -38.78 64.19 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.206 -0.452 . . . . 60.420000000000002 110.882 179.935 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -68.23 -34.3 75.98 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.186 -0.461 . . . . 73.219999999999999 110.92 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 19.9 tp10 -67.12 -42.3 84.75 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.117 -0.492 . . . . 75.340000000000003 110.902 -179.962 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 63.6 t -60.34 -34.54 57.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.124 -0.489 . . . . 74.230000000000004 111.127 179.976 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -51.95 -46.95 64.95 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.199 -0.455 . . . . 73.129999999999995 110.837 179.92 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 35.2 tp10 -57.6 -29.26 64.36 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.214 -0.448 . . . . 75.299999999999997 110.867 -179.875 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 35.4 mtp -75.96 -58.06 3.5 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.162 -0.472 . . . . 73.049999999999997 110.862 -179.996 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 33.3 mm -54.0 -35.31 28.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.213 -0.449 . . . . 75.200000000000003 111.109 179.982 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 51.8 ttm-85 -69.01 -31.72 70.75 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.199 -0.455 . . . . 74.409999999999997 110.897 179.952 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -69.01 -40.5 78.65 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.134 -0.485 . . . . 72.549999999999997 110.888 -179.944 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -83.82 -27.34 28.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.133 -0.485 . . . . 73.329999999999998 111.105 179.946 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 50.7 t0 -74.54 86.6 2.09 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.21 -0.45 . . . . 73.340000000000003 110.881 179.944 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 90.1 mt -80.08 -45.57 22.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.239 -0.437 . . . . 74.400000000000006 111.152 179.966 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 16.6 p30 -71.43 -8.93 57.05 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.152 -0.476 . . . . 54.43 110.83 179.916 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 63.13 43.01 99.33 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.711 -0.756 . . . . 74.310000000000002 112.49 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 17.2 p-10 -88.9 -15.91 33.2 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.864 0.364 . . . . 73.299999999999997 110.826 -179.934 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 100.36 5.33 54.45 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.721 -0.752 . . . . 63.409999999999997 112.434 -179.966 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -149.33 172.16 15.35 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.821 0.343 . . . . 74.420000000000002 110.918 -179.823 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 136' ' ' VAL . . . . . . . . . . . . . 98.4 t -113.63 115.97 51.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.234 -0.439 . . . . 72.450000000000003 111.097 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 45.9 p-10 -93.87 167.83 11.37 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.183 -0.462 . . . . 73.340000000000003 110.862 179.978 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 61.3 t80 -53.2 -41.94 65.8 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.159 -0.473 . . . . 75.129999999999995 110.948 -179.958 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 22.9 tp10 -57.11 -40.62 77.43 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.119 -0.491 . . . . 72.109999999999999 110.927 180.0 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -78.52 -29.94 46.79 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.088 -0.505 . . . . 75.099999999999994 110.859 -179.934 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 53.7 t80 -71.97 -37.1 69.97 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.184 -0.462 . . . . 74.450000000000003 110.918 -179.938 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 85.7 t -64.74 -44.94 96.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.12 -0.491 . . . . 73.140000000000001 111.165 179.929 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 42.2 tt0 -63.04 -27.97 69.77 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.161 -0.472 . . . . 71.120000000000005 110.906 -179.988 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 3.9 tpt -74.61 -54.96 6.45 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.183 -0.462 . . . . 75.010000000000005 110.859 180.0 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 12.8 ttm -65.54 -27.23 68.3 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.217 -0.447 . . . . 70.239999999999995 110.871 179.951 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 1.3 m -108.74 21.33 17.4 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.243 -0.435 . . . . 73.230000000000004 111.149 -179.916 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -51.65 143.08 13.21 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.184 -0.462 . . . . 73.540000000000006 111.075 179.857 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 29.8 ttmt . . . . . 0 C--N 1.328 -0.34 0 CA-C-N 116.238 -0.437 . . . . 75.129999999999995 110.926 179.956 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' M' M ' 8' ' ' LEU . . . . . . . . . . . . . 2.6 pp . . . . . 0 C--O 1.231 0.108 0 CA-C-O 120.831 0.348 . . . . 72.329999999999998 110.924 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' M' M ' 9' ' ' SER . . . . . . . . . . . . . 16.6 m -117.69 -64.26 1.32 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.185 -0.461 . . . . 71.439999999999998 110.898 -179.979 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' M' M ' 10' ' ' GLY . . . . . . . . . . . . . . . 165.73 64.87 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.759 -0.734 . . . . 61.229999999999997 112.546 -180.0 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' M' M ' 11' ' ' GLY . . . . . . . . . . . . . . . 97.08 30.03 7.67 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.714 -0.755 . . . . 71.129999999999995 112.493 -179.867 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' M' M ' 12' ' ' GLU . . . . . . . . . . . . . 21.2 mt-10 -98.37 171.77 7.97 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.875 0.369 . . . . 74.209999999999994 110.862 -179.853 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' M' M ' 13' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -88.21 75.82 8.54 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.132 -0.485 . . . . 75.540000000000006 110.894 -179.949 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' M' M ' 14' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -103.03 26.1 8.6 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.203 -0.453 . . . . 74.450000000000003 110.838 179.857 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' M' M ' 15' ' ' LYS . . . . . . . . . . . . . 16.2 mttm -68.77 -46.04 69.81 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.199 -0.455 . . . . 73.430000000000007 110.904 179.958 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' M' M ' 16' ' ' TRP . . . . . . . . . . . . . 34.3 m95 -52.06 -39.08 59.12 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.257 -0.428 . . . . 73.310000000000002 110.872 179.977 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' M' M ' 17' ' ' GLU . . . . . . . . . . . . . 17.2 tt0 -55.73 -34.2 64.94 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.255 -0.429 . . . . 71.319999999999993 110.89 -179.977 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' M' M ' 18' ' ' LYS . . . . . . . . . . . . . 6.3 ttmm -68.52 -22.18 64.53 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.198 -0.456 . . . . 75.230000000000004 110.862 -179.995 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' M' M ' 19' ' ' ILE . . . . . . . . . . . . . 24.2 mm -69.76 -33.61 57.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.192 -0.458 . . . . 64.329999999999998 111.119 179.868 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' M' M ' 20' ' ' ARG . . . . . . . . . . . . . 35.0 ttp180 -51.86 -30.3 23.21 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.194 -0.457 . . . . 75.129999999999995 110.871 179.978 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' M' M ' 21' ' ' LEU . . . . . . . . . . . . . 5.5 mt 55.57 -175.67 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.158 -0.473 . . . . 70.010000000000005 110.905 -179.995 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' M' M ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -109.43 155.45 41.2 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.589 0.709 . . . . 72.329999999999998 110.87 179.954 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' M' M ' 23' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.83 174.07 10.11 Favored 'Trans proline' 0 C--N 1.341 0.147 0 C-N-CA 122.68 2.253 . . . . 73.230000000000004 112.316 -179.98 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' M' M ' 24' ' ' GLY . . . . . . . . . . . . . . . 112.04 69.33 0.55 Allowed Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.707 -0.759 . . . . 51.340000000000003 112.486 -179.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' M' M ' 25' ' ' GLY . . . . . . . . . . . . . . . -159.07 -148.21 5.12 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.703 -0.761 . . . . 65.140000000000001 112.488 -179.961 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' M' M ' 26' ' ' LYS . . . . . . . . . . . . . 13.3 tptm -73.51 160.7 31.3 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.88 0.371 . . . . 73.319999999999993 110.862 -179.971 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' M' M ' 27' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.27 147.37 31.53 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.191 -0.459 . . . . 74.299999999999997 110.933 179.856 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' M' M ' 28' ' ' GLN . . . . . . . . . . . . . 7.6 tp60 -176.58 126.18 0.18 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.238 -0.437 . . . . 74.049999999999997 110.925 -179.995 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' M' M ' 29' ' ' TYR . . . . . . . . . . . . . 5.0 t80 -63.48 -71.59 0.16 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.214 -0.448 . . . . 74.140000000000001 110.962 -179.877 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' M' M ' 30' ' ' LYS . . . . . . . . . . . . . 9.2 tttt 173.38 -46.44 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.114 -0.494 . . . . 74.340000000000003 110.88 179.869 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' M' M ' 31' ' ' LEU . . . . . . . . . . . . . 8.1 tp -96.47 -36.19 10.88 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.279 -0.418 . . . . 74.319999999999993 110.914 179.959 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' M' M ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -47.41 -34.4 7.11 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.139 -0.482 . . . . 64.340000000000003 110.886 179.855 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' M' M ' 33' ' ' HIS . . . . . . . . . . . . . 3.4 t60 -52.02 -45.78 64.72 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.212 -0.449 . . . . 74.230000000000004 110.868 179.926 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' M' M ' 34' ' ' ILE . . . . . . . . . . . . . 60.8 mt -51.82 -35.32 17.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.142 -0.481 . . . . 74.049999999999997 111.136 179.97 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' M' M ' 35' ' ' VAL . . . . . . . . . . . . . 46.2 t -49.95 -39.58 15.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.194 -0.457 . . . . 75.409999999999997 111.143 179.865 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' M' M ' 36' ' ' TRP . . . . . . . . . . . . . 18.3 m0 -58.79 -39.48 81.18 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.14 -0.482 . . . . 75.239999999999995 110.976 179.907 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' M' M ' 37' ' ' ALA . . . . . . . . . . . . . . . -63.85 -18.52 64.24 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.229 -0.441 . . . . 63.149999999999999 111.102 179.859 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' M' M ' 38' ' ' SER . . . . . . . . . . . . . 1.4 m -68.75 -17.81 64.11 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.242 -0.435 . . . . 63.310000000000002 110.842 -179.765 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' M' M ' 39' ' ' ARG . . . . . . . . . . . . . 51.3 mtp85 -51.73 -29.97 20.62 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.136 -0.484 . . . . 74.510000000000005 110.884 -179.968 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' M' M ' 40' ' ' GLU . . . . . . . . . . . . . 28.7 mm-40 -80.07 -47.28 15.09 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.192 -0.458 . . . . 74.319999999999993 110.908 -179.939 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' M' M ' 41' ' ' LEU . . . . . . . . . . . . . 8.3 mt -61.01 176.62 0.4 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.108 -0.496 . . . . 75.329999999999998 110.932 -179.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' M' M ' 42' ' ' GLU . . . . . . . . . . . . . 16.5 tt0 -171.78 161.92 6.06 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.231 -0.44 . . . . 74.329999999999998 110.881 179.93 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' M' M ' 43' ' ' ARG . . . . . . . . . . . . . 11.0 mmm180 . . . . . 0 C--N 1.329 -0.3 0 CA-C-N 116.137 -0.483 . . . . 75.340000000000003 110.851 -179.887 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 241' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 262' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 301' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 322' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.146 0 CA-C-O 120.782 0.325 . . . . 62.5 111.05 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 4.0 p-10 -60.49 -38.46 84.39 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.287 -0.415 . . . . 71.25 110.837 179.999 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 69.21 -75.53 0.07 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.173 -0.467 . . . . 74.239999999999995 110.942 -179.891 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 9.1 mt -111.0 170.13 8.31 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.204 -0.453 . . . . 71.409999999999997 110.915 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 50.1 p -117.28 171.91 7.65 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.198 -0.456 . . . . 71.420000000000002 111.102 179.959 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 31.5 tt0 -53.63 -33.8 56.36 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.194 -0.457 . . . . 74.519999999999996 110.886 179.958 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 27.4 tt0 -60.77 -27.97 68.39 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.184 -0.462 . . . . 72.129999999999995 110.933 -179.963 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 8.2 tp-100 -78.02 -43.46 29.39 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.134 -0.485 . . . . 74.319999999999993 110.932 -179.975 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 4.4 mp -71.41 -38.64 69.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.217 -0.447 . . . . 75.400000000000006 111.134 179.957 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -53.42 -40.13 64.88 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.154 -0.476 . . . . 75.450000000000003 111.127 179.795 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -74.65 -50.48 17.57 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.17 -0.468 . . . . 62.109999999999999 110.884 -179.927 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 16.5 m-85 -55.89 -37.62 69.08 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.16 -0.473 . . . . 62.439999999999998 110.904 -179.926 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 26.1 tttm -54.63 -37.27 65.43 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.155 -0.475 . . . . 75.310000000000002 110.935 179.916 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -68.24 -34.18 75.76 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.239 -0.437 . . . . 74.010000000000005 110.889 179.997 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -67.68 -28.21 67.49 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.141 -0.481 . . . . 51.229999999999997 111.082 179.934 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 91.0 t80 -75.64 -54.22 7.33 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.251 -0.432 . . . . 74.430000000000007 110.863 -179.897 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 9.4 t -54.32 -27.57 36.59 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.209 -0.451 . . . . 72.310000000000002 110.812 -179.769 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 16.3 tp -65.18 -38.87 91.89 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.179 -0.464 . . . . 74.209999999999994 110.928 -179.992 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 19.8 m-85 -81.46 -24.76 36.59 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.198 -0.455 . . . . 71.239999999999995 110.911 179.932 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 11.7 t0 -83.35 98.6 9.55 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.139 -0.482 . . . . 65.120000000000005 110.788 179.996 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 21.1 mmmt -67.27 -50.96 58.4 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.16 -0.473 . . . . 74.209999999999994 110.907 179.933 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 22.2 p-10 -80.93 -10.16 59.75 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.217 -0.447 . . . . 70.109999999999999 110.893 179.86 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 51.64 42.3 51.64 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.746 -0.74 . . . . 74.319999999999993 112.481 -179.969 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 34.1 p-10 -88.25 -15.15 36.64 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.838 0.351 . . . . 75.329999999999998 110.858 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 105.4 -11.18 47.13 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.711 -0.756 . . . . 42.439999999999998 112.502 -179.924 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 7.3 p -127.97 130.75 48.9 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.791 0.329 . . . . 72.5 111.162 -179.882 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 22.0 mt -104.29 109.79 28.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.222 -0.444 . . . . 73.519999999999996 111.127 179.913 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 20.1 p -95.47 -176.88 3.9 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.173 -0.467 . . . . 72.439999999999998 111.144 179.964 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 69.5 p -66.11 -27.45 68.06 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.21 -0.45 . . . . 74.329999999999998 111.168 -179.99 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.07 -49.99 17.9 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.172 -0.467 . . . . 72.420000000000002 110.928 179.885 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 23.8 mt-10 -70.61 -40.15 73.34 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.198 -0.455 . . . . 71.430000000000007 110.863 179.967 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 3.8 tt -74.31 -49.69 21.93 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.195 -0.457 . . . . 75.230000000000004 110.857 -179.914 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -54.63 -31.5 52.99 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.731 -0.747 . . . . 71.030000000000001 112.509 179.905 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 96.3 m -73.38 -47.04 45.33 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.814 0.34 . . . . 73.200000000000003 111.125 -179.856 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 51.7 t -54.54 -54.34 23.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.229 -0.441 . . . . 75.239999999999995 111.151 179.892 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 8.2 ptm -65.72 -36.73 84.44 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.136 -0.484 . . . . 64.230000000000004 110.872 179.932 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 52.4 ttt85 -54.31 -37.31 64.68 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.244 -0.434 . . . . 63.130000000000003 110.921 -179.962 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -70.04 -23.63 63.13 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.2 -0.455 . . . . 74.329999999999998 110.883 -179.816 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 18.3 mt -85.59 -10.72 55.45 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.121 -0.491 . . . . 73.549999999999997 110.919 179.978 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 101.78 22.49 10.14 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.772 -0.728 . . . . 73.030000000000001 112.482 179.871 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 3.8 mp0 -121.22 96.81 5.24 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.787 0.327 . . . . 74.140000000000001 110.935 -179.891 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 52.5 t30 -109.89 79.34 1.45 Allowed Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.63 0.729 . . . . 71.349999999999994 110.908 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.79 168.21 22.25 Favored 'Trans proline' 0 C--O 1.232 0.205 0 C-N-CA 122.685 2.256 . . . . 71.120000000000005 112.344 179.964 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 24.7 p -79.22 159.9 27.13 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.224 -0.444 . . . . 75.319999999999993 111.146 -179.969 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -51.66 -45.72 63.49 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.197 -0.456 . . . . 73.439999999999998 110.88 -179.958 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -68.42 -31.39 70.7 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.142 -0.481 . . . . 72.030000000000001 111.081 179.969 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 76.9 tt0 -69.7 -44.81 69.65 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.261 -0.427 . . . . 74.310000000000002 110.834 -179.922 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 27.3 mt -56.35 -51.88 66.65 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.165 -0.471 . . . . 73.129999999999995 110.913 -179.958 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 24.2 tp60 -66.1 -28.03 68.51 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.183 -0.462 . . . . 75.140000000000001 110.879 179.958 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 23.4 t0 -56.26 -49.66 73.57 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.183 -0.462 . . . . 60.229999999999997 110.845 -179.977 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 8.0 ptp -74.07 -36.91 64.36 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.216 -0.447 . . . . 72.129999999999995 110.934 179.953 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 91.1 mt -62.55 -38.27 81.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.218 -0.446 . . . . 71.019999999999996 111.128 179.966 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 15.1 m-20 -66.61 -24.66 66.35 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.181 -0.463 . . . . 75.5 110.891 179.952 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -76.22 -26.53 56.18 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.129 -0.487 . . . . 71.450000000000003 110.875 179.978 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 4.4 m -108.41 8.39 9.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.202 -0.454 . . . . 74.430000000000007 111.161 179.956 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 30.8 t0 -82.99 98.39 9.23 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.15 -0.477 . . . . 74.409999999999997 110.84 179.936 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.28 -43.02 11.87 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.203 -0.453 . . . . 62.219999999999999 111.067 179.961 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 43.5 p30 -84.26 -0.12 51.08 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.191 -0.459 . . . . 73.5 110.882 179.974 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 54.84 54.8 31.13 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.756 -0.735 . . . . 73.319999999999993 112.497 -179.933 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 49.7 p-10 -114.56 -15.67 11.97 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.875 0.369 . . . . 75.230000000000004 110.893 -179.869 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 94.16 18.56 36.21 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.744 -0.741 . . . . 72.310000000000002 112.527 179.994 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 20.4 p -145.62 175.52 10.3 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.776 0.322 . . . . 73.400000000000006 111.082 -179.844 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 18.9 mt -108.75 110.6 32.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.194 -0.457 . . . . 73.450000000000003 111.132 179.922 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.0 t0 -76.02 -172.93 2.15 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.199 -0.455 . . . . 64.230000000000004 110.862 179.9 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.509 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 2.4 t80 -64.76 -58.19 13.96 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-O 121.675 0.75 . . . . 72.129999999999995 110.893 -179.878 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . 0.509 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 54.0 Cg_endo -69.72 -26.8 27.41 Favored 'Trans proline' 0 C--N 1.342 0.208 0 C-N-CA 122.696 2.264 . . . . 73.010000000000005 112.331 179.972 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 63.0 mt-10 -61.59 -40.46 94.85 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.232 -0.44 . . . . 71.150000000000006 110.918 -179.976 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 25.1 t80 -74.44 -35.83 63.37 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.163 -0.471 . . . . 74.540000000000006 110.86 -179.93 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 35.3 tp -69.61 -54.06 15.79 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.107 -0.497 . . . . 75.239999999999995 110.914 -179.94 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 14.6 t -52.82 -30.38 33.07 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.182 -0.463 . . . . 62.119999999999997 111.151 179.966 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 39.2 ttp -60.4 -51.23 70.36 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.197 -0.456 . . . . 74.530000000000001 110.88 179.91 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 5.2 mmt -70.24 -46.03 65.28 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.244 -0.434 . . . . 74.319999999999993 110.906 179.956 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -54.62 -32.54 59.08 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.228 -0.442 . . . . 73.420000000000002 111.093 179.912 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 24.3 ttm180 -60.46 -25.8 66.28 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.219 -0.446 . . . . 73.349999999999994 110.873 -179.897 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 2.7 tmtm? -58.38 -28.33 65.06 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.188 -0.46 . . . . 75.530000000000001 110.864 179.985 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 38.7 mtm -53.28 -41.56 65.69 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.208 -0.451 . . . . 72.209999999999994 110.889 179.829 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -157.11 139.15 14.44 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.239 -0.437 . . . . 71.400000000000006 110.88 179.982 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 -173.81 -177.62 1.42 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.235 -0.439 . . . . 75.099999999999994 110.873 179.848 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 1.9 t -152.36 74.53 1.08 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.198 -0.456 . . . . 72.239999999999995 111.094 -179.867 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -112.7 -26.37 8.64 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.251 -0.431 . . . . 75.340000000000003 110.889 179.896 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 1.7 p -52.19 -52.55 51.45 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.167 -0.47 . . . . 74.209999999999994 110.846 -179.741 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -72.87 -27.21 61.77 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.11 -0.495 . . . . 72.099999999999994 110.919 -179.96 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 18.3 tt0 -66.18 -36.15 82.34 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.097 -0.502 . . . . 70.140000000000001 110.896 -179.929 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -62.08 -36.36 81.45 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.167 -0.469 . . . . 73.040000000000006 110.874 -179.935 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 68.8 mt -75.1 -50.98 22.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.123 -0.489 . . . . 72.450000000000003 111.104 -179.975 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 34.9 ttm180 -63.41 -28.23 69.84 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.2 -0.455 . . . . 73.25 110.855 179.957 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -63.8 -50.91 67.12 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.245 -0.434 . . . . 63.009999999999998 110.84 -179.889 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -66.13 -44.02 85.41 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.195 -0.457 . . . . 75.019999999999996 111.1 179.962 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 5.7 t80 -51.97 -48.02 64.55 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.184 -0.462 . . . . 74.319999999999993 110.863 -179.921 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 4.3 ttt-85 -63.78 -39.9 95.38 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.157 -0.474 . . . . 72.439999999999998 110.864 -179.911 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 90.4 t -59.37 -33.53 51.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.213 -0.448 . . . . 73.230000000000004 111.142 179.982 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 8.6 m-85 -89.98 -26.19 20.49 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.191 -0.458 . . . . 75.510000000000005 110.89 -179.986 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 17.1 t0 -73.97 95.6 2.52 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.16 -0.473 . . . . 60.119999999999997 110.834 -179.999 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 13.5 mtpt -78.67 -53.25 7.35 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.224 -0.444 . . . . 74.409999999999997 110.922 179.963 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 48.9 p30 -73.55 -9.15 58.38 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.239 -0.437 . . . . 74.549999999999997 110.909 179.841 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 60.35 31.54 74.26 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.724 -0.75 . . . . 72.400000000000006 112.494 -179.92 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 45.6 p-10 -86.24 -16.2 38.42 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.856 0.36 . . . . 75.209999999999994 110.879 -179.891 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 89.91 18.73 49.98 Favored Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.69 -0.767 . . . . 62.350000000000001 112.492 -179.975 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 14.1 m-85 -134.58 155.68 50.02 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.921 0.391 . . . . 74.25 110.912 -179.839 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 68.5 mt -122.77 121.44 63.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.136 -0.484 . . . . 72.109999999999999 111.11 179.957 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 59.7 p -114.59 176.53 5.01 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.172 -0.467 . . . . 71.519999999999996 110.872 -179.899 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -66.08 -24.95 66.81 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.133 -0.485 . . . . 71.510000000000005 111.113 179.909 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -71.81 -49.91 34.39 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.164 -0.471 . . . . 62.32 111.108 179.949 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -76.63 -47.77 21.21 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.213 -0.449 . . . . 74.340000000000003 110.855 -179.877 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 23.5 tp -52.95 -50.75 63.43 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.183 -0.462 . . . . 72.030000000000001 110.909 -179.974 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 64.2 ttt-85 -52.32 -37.81 56.91 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.199 -0.455 . . . . 75.230000000000004 110.897 179.942 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 43.6 t60 -58.93 -34.4 71.7 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.14 -0.482 . . . . 72.239999999999995 110.873 179.982 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 21.7 t -74.47 -49.12 32.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.217 -0.447 . . . . 72.040000000000006 111.123 179.955 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 3.9 mmt -64.91 -27.16 68.66 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.185 -0.461 . . . . 75.219999999999999 110.894 179.921 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 18.9 p -75.32 -48.3 23.77 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.238 -0.437 . . . . 71.430000000000007 111.164 -179.944 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 12.2 t30 -56.61 -26.62 56.13 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.241 -0.436 . . . . 75.310000000000002 110.889 179.967 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 6.6 mt -70.72 -22.52 62.43 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.184 -0.462 . . . . 73.430000000000007 110.92 179.958 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 101.09 33.09 5.06 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.771 -0.728 . . . . 74.109999999999999 112.444 179.882 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 24.7 mm-40 -122.28 109.97 15.11 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.899 0.38 . . . . 74.219999999999999 110.871 -179.89 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 28.0 tptt -65.44 137.1 57.23 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.188 -0.46 . . . . 74.140000000000001 110.874 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 48.2 mt -145.76 150.71 36.73 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.209 -0.45 . . . . 74.5 110.914 179.929 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 73.2 p -100.49 170.05 8.65 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.219 -0.446 . . . . 74.140000000000001 111.145 179.96 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -53.06 -44.61 67.6 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.25 -0.432 . . . . 74.319999999999993 110.845 179.891 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 -70.38 -45.44 66.04 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.239 -0.437 . . . . 74.209999999999994 110.884 -179.891 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -55.08 -32.18 61.77 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.185 -0.461 . . . . 74.209999999999994 110.898 -179.948 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 73.9 t -69.59 -30.85 46.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.206 -0.452 . . . . 74.319999999999993 111.143 179.964 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -78.49 -28.52 46.36 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.12 -0.491 . . . . 72.140000000000001 110.878 179.9 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -55.74 -50.01 71.55 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.172 -0.467 . . . . 74.439999999999998 110.876 -179.867 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 12.4 ptm -66.72 -44.31 81.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.167 -0.47 . . . . 74.019999999999996 110.929 179.911 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 28.4 mm -53.94 -35.43 28.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.216 -0.447 . . . . 64.120000000000005 111.153 179.956 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 23.0 ttp180 -66.8 -31.78 72.63 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.16 -0.473 . . . . 74.540000000000006 110.844 179.95 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 10.1 tm-20 -68.83 -40.0 79.68 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.187 -0.461 . . . . 75.420000000000002 110.857 -179.928 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -82.57 -29.6 30.17 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.178 -0.464 . . . . 71.109999999999999 111.105 179.951 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 43.3 t0 -68.39 86.91 0.29 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.23 -0.441 . . . . 73.230000000000004 110.915 179.949 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 81.3 mt -79.69 -48.42 20.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.173 -0.467 . . . . 65.129999999999995 111.16 -179.955 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 18.7 p30 -73.01 -8.6 56.45 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.157 -0.474 . . . . 72.120000000000005 110.835 179.846 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 63.49 43.05 98.72 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.739 -0.743 . . . . 43.240000000000002 112.517 -179.915 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 25.8 p-10 -89.53 -15.8 32.13 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.868 0.366 . . . . 65.329999999999998 110.856 -179.909 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 102.96 3.51 48.73 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.723 -0.751 . . . . 70.200000000000003 112.484 179.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -149.14 172.11 15.34 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.852 0.358 . . . . 72.340000000000003 110.905 -179.84 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 136' ' ' VAL . . . . . . . . . . . . . 82.7 t -107.67 109.18 27.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.211 -0.45 . . . . 71.530000000000001 111.149 179.937 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 20.8 p30 -92.04 164.76 13.49 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.183 -0.462 . . . . 75.129999999999995 110.888 -179.978 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 15.5 t80 -52.3 -45.73 65.66 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.172 -0.467 . . . . 73.439999999999998 110.909 -179.868 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -52.01 -40.07 60.42 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.155 -0.475 . . . . 75.239999999999995 110.864 -179.986 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 24.2 mt-10 -78.42 -48.47 15.38 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.223 -0.444 . . . . 75.450000000000003 110.856 -179.928 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 47.6 t80 -54.17 -40.55 67.59 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.123 -0.489 . . . . 74.140000000000001 110.878 -179.916 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 92.6 t -69.23 -38.77 78.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.138 -0.483 . . . . 73.519999999999996 111.145 179.981 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 50.8 tt0 -68.66 -41.23 79.63 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.153 -0.476 . . . . 73.420000000000002 110.943 -179.992 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -74.73 -51.81 13.24 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.198 -0.455 . . . . 63.119999999999997 110.857 179.979 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 32.9 tpp -51.92 -30.11 22.95 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.209 -0.451 . . . . 71.310000000000002 110.929 179.901 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 89.6 m -92.58 -27.56 17.28 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.236 -0.438 . . . . 70.319999999999993 111.133 -179.95 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -56.3 140.65 44.31 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.251 -0.431 . . . . 72.049999999999997 111.102 179.839 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 11.0 tptm . . . . . 0 C--N 1.328 -0.34 0 CA-C-N 116.21 -0.45 . . . . 75.349999999999994 110.874 179.993 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' M' M ' 8' ' ' LEU . . . . . . . . . . . . . 11.4 mt . . . . . 0 C--O 1.231 0.086 0 CA-C-O 120.867 0.365 . . . . 63.200000000000003 110.946 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' M' M ' 9' ' ' SER . . . . . . . . . . . . . 10.3 t -133.01 174.57 10.22 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.172 -0.467 . . . . 73.140000000000001 110.869 -179.93 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' M' M ' 10' ' ' GLY . . . . . . . . . . . . . . . -155.94 -108.18 0.28 Allowed Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.718 -0.754 . . . . 63.119999999999997 112.457 -179.96 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' M' M ' 11' ' ' GLY . . . . . . . . . . . . . . . 111.89 -129.69 9.24 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.734 -0.746 . . . . 72.109999999999999 112.498 -179.897 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' M' M ' 12' ' ' GLU . . . . . . . . . . . . . 16.8 mm-40 -64.18 -169.96 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.882 0.372 . . . . 55.539999999999999 110.865 -179.895 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' M' M ' 13' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -76.23 77.52 3.03 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.133 -0.485 . . . . 73.239999999999995 110.912 179.97 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' M' M ' 14' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -98.98 15.43 25.77 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.18 -0.464 . . . . 72.349999999999994 110.865 179.829 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' M' M ' 15' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.99 -42.05 70.16 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.204 -0.453 . . . . 74.400000000000006 110.873 -179.993 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' M' M ' 16' ' ' TRP . . . . . . . . . . . . . 32.2 m95 -56.59 -28.13 59.61 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.228 -0.442 . . . . 74.219999999999999 110.887 179.947 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' M' M ' 17' ' ' GLU . . . . . . . . . . . . . 9.5 tt0 -54.04 -30.26 47.1 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.267 -0.424 . . . . 73.430000000000007 110.916 -179.992 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' M' M ' 18' ' ' LYS . . . . . . . . . . . . . 2.3 ttmp? -60.77 -25.96 66.89 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.132 -0.485 . . . . 74.209999999999994 110.878 179.969 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' M' M ' 19' ' ' ILE . . . . . . . . . . . . . 29.4 mt -103.5 -42.06 7.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.245 -0.434 . . . . 74.349999999999994 111.161 179.866 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' M' M ' 20' ' ' ARG . . . . . . . . . . . . . 46.0 ttp180 -66.69 -22.23 66.08 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.174 -0.466 . . . . 74.519999999999996 110.839 -179.969 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' M' M ' 21' ' ' LEU . . . . . . . . . . . . . 5.9 mt 63.42 160.64 0.09 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.167 -0.47 . . . . 73.319999999999993 110.935 -179.945 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' M' M ' 22' ' ' ARG . . . . . . . . . . . . . 50.8 ttm-85 -78.57 136.83 59.34 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.614 0.721 . . . . 74.420000000000002 110.853 179.96 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' M' M ' 23' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.83 93.15 0.52 Allowed 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.69 2.26 . . . . 72.439999999999998 112.295 -179.98 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' M' M ' 24' ' ' GLY . . . . . . . . . . . . . . . -148.48 52.5 0.54 Allowed Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.71 -0.757 . . . . 73.209999999999994 112.458 179.948 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' M' M ' 25' ' ' GLY . . . . . . . . . . . . . . . 169.5 84.77 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.746 -0.74 . . . . 71.209999999999994 112.462 -179.938 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' M' M ' 26' ' ' LYS . . . . . . . . . . . . . 25.5 mtpp -97.86 29.97 3.2 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.819 0.342 . . . . 73.239999999999995 110.889 -179.98 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' M' M ' 27' ' ' LYS . . . . . . . . . . . . . 8.0 tttm -148.88 145.19 27.34 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.232 -0.44 . . . . 73.329999999999998 110.868 179.888 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' M' M ' 28' ' ' GLN . . . . . . . . . . . . . 7.9 pt20 -56.87 163.75 1.83 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.181 -0.463 . . . . 74.150000000000006 110.927 179.943 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' M' M ' 29' ' ' TYR . . . . . . . . . . . . . 47.0 m-85 57.56 179.1 0.05 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.191 -0.459 . . . . 73.120000000000005 110.938 -179.878 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' M' M ' 30' ' ' LYS . . . . . . . . . . . . . 5.4 ttmm -144.24 15.05 1.66 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.153 -0.476 . . . . 54.25 110.903 179.885 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' M' M ' 31' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -118.52 -28.93 5.58 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.195 -0.457 . . . . 73.420000000000002 110.908 179.918 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' M' M ' 32' ' ' LYS . . . . . . . . . . . . . 1.8 mttp -48.9 -44.44 40.16 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.184 -0.462 . . . . 55.100000000000001 110.875 179.823 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' M' M ' 33' ' ' HIS . . . . . . . . . . . . . 56.5 t-80 -50.26 -39.78 46.05 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.212 -0.449 . . . . 71.219999999999999 110.908 179.903 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' M' M ' 34' ' ' ILE . . . . . . . . . . . . . 29.2 mt -50.31 -39.86 17.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.182 -0.463 . . . . 72.200000000000003 111.137 179.974 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' M' M ' 35' ' ' VAL . . . . . . . . . . . . . 61.2 t -48.81 -40.71 12.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.204 -0.453 . . . . 63.210000000000001 111.096 179.844 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' M' M ' 36' ' ' TRP . . . . . . . . . . . . . 21.4 m0 -59.2 -39.74 83.57 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.214 -0.448 . . . . 74.510000000000005 110.916 -179.995 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' M' M ' 37' ' ' ALA . . . . . . . . . . . . . . . -63.21 -18.7 63.8 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.226 -0.443 . . . . 73.420000000000002 111.089 179.858 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' M' M ' 38' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -66.29 -18.03 65.11 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.259 -0.428 . . . . 75.209999999999994 110.857 -179.792 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' M' M ' 39' ' ' ARG . . . . . . . . . . . . . 12.5 ptt180 -55.62 -25.74 40.45 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.109 -0.496 . . . . 74.349999999999994 110.866 -179.946 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' M' M ' 40' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -91.3 -47.97 7.18 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.203 -0.453 . . . . 73.310000000000002 110.894 -179.931 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' M' M ' 41' ' ' LEU . . . . . . . . . . . . . 10.8 mt -67.41 130.42 43.01 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.182 -0.463 . . . . 75.409999999999997 110.88 -179.97 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' M' M ' 42' ' ' GLU . . . . . . . . . . . . . 22.9 tp10 -93.72 -28.46 15.94 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.228 -0.442 . . . . 73.450000000000003 110.887 179.921 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' M' M ' 43' ' ' ARG . . . . . . . . . . . . . 10.2 mpt_? . . . . . 0 C--N 1.329 -0.293 0 CA-C-N 116.111 -0.495 . . . . 73.540000000000006 110.87 -179.899 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 241' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 262' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 301' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 322' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.131 0 CA-C-O 120.761 0.315 . . . . 72.140000000000001 111.079 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 12.2 t0 56.59 29.62 15.89 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.237 -0.438 . . . . 75.409999999999997 110.858 -179.986 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 46.8 tt0 -144.99 142.74 30.06 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.188 -0.46 . . . . 73.209999999999994 110.928 -179.943 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 9.3 mt -82.29 136.85 34.97 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.174 -0.466 . . . . 70.25 110.893 -179.97 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 1.4 p -89.38 170.19 10.75 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.176 -0.466 . . . . 74.400000000000006 111.141 179.982 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 6.6 tm-20 -53.31 -41.31 65.55 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.233 -0.44 . . . . 73.209999999999994 110.876 -179.994 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -63.55 -26.7 68.82 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.143 -0.48 . . . . 72.209999999999994 110.899 -179.922 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 13.8 tt0 -76.9 -54.54 6.45 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.151 -0.477 . . . . 75.400000000000006 110.896 -179.939 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 3.3 mp -65.96 -50.35 70.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.232 -0.44 . . . . 74.230000000000004 111.133 179.973 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -56.02 -25.47 44.68 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.189 -0.46 . . . . 71.450000000000003 111.12 179.812 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 14.2 tp10 -75.17 -38.39 60.91 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.206 -0.452 . . . . 72.140000000000001 110.856 -179.948 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 54.2 m-85 -76.28 -46.13 29.32 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.175 -0.466 . . . . 73.420000000000002 110.911 -179.908 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 7.8 ptmm? -57.25 -29.39 63.77 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.183 -0.462 . . . . 73.200000000000003 110.919 179.945 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -66.82 -37.54 84.72 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.194 -0.457 . . . . 74.040000000000006 110.889 179.939 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -67.03 -37.17 83.64 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.159 -0.473 . . . . 71.409999999999997 111.089 179.934 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 77.4 t80 -59.45 -54.31 48.14 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.227 -0.442 . . . . 64.540000000000006 110.878 -179.895 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 41.5 t -56.3 -28.13 57.77 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.118 -0.492 . . . . 74.510000000000005 110.833 -179.767 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 15.5 tp -65.5 -40.79 93.47 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.138 -0.483 . . . . 74.299999999999997 110.894 -179.985 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 43.1 m-85 -80.49 -24.67 39.26 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.2 -0.454 . . . . 74.409999999999997 110.858 179.973 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 9.8 t0 -79.44 98.61 6.85 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.165 -0.471 . . . . 75.0 110.849 179.998 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.68 -47.06 82.74 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.193 -0.458 . . . . 64.5 110.816 -179.966 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 24.4 p-10 -86.89 -10.21 53.89 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.246 -0.434 . . . . 74.420000000000002 110.905 179.894 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 51.41 46.23 52.63 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.728 -0.749 . . . . 75.0 112.49 -179.953 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 29.5 p-10 -88.73 -14.06 38.13 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.843 0.354 . . . . 72.549999999999997 110.89 -179.984 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 105.35 13.41 24.66 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.788 -0.72 . . . . 53.539999999999999 112.491 -179.95 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 1.4 p -154.65 142.26 19.82 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.772 0.32 . . . . 54.140000000000001 111.108 -179.872 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 25.1 mt -101.84 124.99 56.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.209 -0.45 . . . . 75.099999999999994 111.102 179.943 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 39.5 p -110.05 174.83 5.68 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.188 -0.46 . . . . 71.239999999999995 111.141 179.929 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 61.0 p -61.07 -31.89 71.54 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.178 -0.464 . . . . 72.5 111.134 179.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.84 -49.93 12.11 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.224 -0.444 . . . . 75.219999999999999 110.906 179.937 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 23.3 mt-10 -61.26 -33.62 73.84 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.211 -0.45 . . . . 63.539999999999999 110.908 179.958 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.1 tt -74.24 -55.11 6.43 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.12 -0.491 . . . . 72.420000000000002 110.926 -179.994 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -52.22 -27.87 24.98 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.747 -0.74 . . . . 74.120000000000005 112.461 179.948 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 54.8 m -63.69 -59.18 4.92 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.797 0.332 . . . . 73.329999999999998 111.12 -179.861 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 36.3 t -52.62 -49.29 45.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.208 -0.451 . . . . 74.099999999999994 111.09 179.957 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 28.2 mtp -51.83 -35.79 45.75 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.186 -0.461 . . . . 75.099999999999994 110.907 179.904 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 24.5 ttp180 -55.73 -51.88 65.84 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.199 -0.455 . . . . 74.209999999999994 110.891 -179.942 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 3.8 t -66.45 -28.5 68.65 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.179 -0.464 . . . . 75.120000000000005 110.87 -179.816 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 57.6 mt -77.14 -24.3 51.62 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.111 -0.495 . . . . 72.400000000000006 110.924 179.963 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 101.35 32.8 5.08 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.756 -0.735 . . . . 70.510000000000005 112.477 179.89 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 17.6 mm-40 -131.09 105.42 7.7 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.853 0.358 . . . . 65.209999999999994 110.897 -179.874 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 59.9 t30 -109.86 76.93 1.01 Allowed Pre-proline 0 C--N 1.33 -0.282 0 CA-C-O 121.619 0.723 . . . . 71.439999999999998 110.878 -179.948 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.83 168.01 22.88 Favored 'Trans proline' 0 C--O 1.231 0.162 0 C-N-CA 122.67 2.247 . . . . 72.120000000000005 112.315 179.965 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 76.7 p -86.95 157.53 19.47 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.209 -0.45 . . . . 74.319999999999993 111.14 -179.958 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -52.28 -39.22 60.17 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.233 -0.44 . . . . 74.340000000000003 110.88 179.984 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -72.13 -32.96 67.41 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.203 -0.453 . . . . 64.219999999999999 111.092 179.946 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 10.1 tt0 -69.7 -49.71 50.79 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.191 -0.458 . . . . 75.219999999999999 110.886 -179.916 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 34.1 mt -55.14 -43.08 73.84 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.163 -0.471 . . . . 73.540000000000006 110.885 -179.955 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 19.4 tp60 -56.42 -33.63 66.01 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.151 -0.477 . . . . 74.140000000000001 110.895 179.951 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -70.18 -37.52 75.16 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.233 -0.439 . . . . 74.409999999999997 110.863 179.988 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 39.6 mtp -65.22 -57.84 7.49 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.204 -0.453 . . . . 75.25 110.88 -179.994 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 62.4 mt -57.61 -42.64 81.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.21 -0.45 . . . . 73.400000000000006 111.167 179.96 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 48.6 m-20 -59.28 -37.19 77.03 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.146 -0.479 . . . . 72.409999999999997 110.842 179.936 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -65.69 -29.87 70.48 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.209 -0.451 . . . . 75.140000000000001 110.88 -179.993 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 14.7 m -103.15 6.64 10.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.144 -0.48 . . . . 75.400000000000006 111.142 179.979 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 31.3 t0 -90.11 96.63 10.76 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.125 -0.489 . . . . 74.120000000000005 110.869 179.927 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.18 -42.0 12.61 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.184 -0.462 . . . . 70.319999999999993 111.118 179.956 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -85.02 0.01 52.9 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.234 -0.439 . . . . 45.210000000000001 110.849 179.99 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 55.03 57.98 15.81 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.754 -0.736 . . . . 74.340000000000003 112.519 -179.924 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 52.2 p-10 -114.6 -15.7 11.95 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.871 0.367 . . . . 72.439999999999998 110.92 -179.917 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 90.06 16.91 55.18 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.738 -0.744 . . . . 74.109999999999999 112.446 179.917 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 46.9 p -151.35 162.85 40.2 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.735 0.302 . . . . 73.099999999999994 111.158 -179.846 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 19.9 mt -96.94 116.99 40.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.184 -0.462 . . . . 74.140000000000001 111.124 179.921 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.4 t0 -81.12 -172.95 4.02 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.199 -0.455 . . . . 74.0 110.864 179.865 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.51 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 2.5 t80 -64.93 -58.4 12.96 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.64 0.733 . . . . 74.540000000000006 110.92 -179.932 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . 0.51 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 54.1 Cg_endo -69.76 -28.73 24.89 Favored 'Trans proline' 0 C--N 1.341 0.158 0 C-N-CA 122.681 2.254 . . . . 72.319999999999993 112.379 179.937 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 23.8 mt-10 -58.24 -45.45 87.73 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.218 -0.447 . . . . 73.430000000000007 110.88 179.992 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 13.2 t80 -71.37 -36.43 71.44 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.149 -0.478 . . . . 72.439999999999998 110.892 -179.948 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 15.3 tp -64.09 -53.7 45.63 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.169 -0.469 . . . . 74.040000000000006 110.922 -179.972 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 14.8 t -61.26 -29.46 69.86 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.189 -0.46 . . . . 75.219999999999999 111.153 179.94 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 5.6 tmm? -63.31 -43.83 96.72 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.223 -0.444 . . . . 74.530000000000001 110.885 179.902 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -79.49 -30.01 41.85 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.223 -0.444 . . . . 73.310000000000002 110.864 179.984 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -74.88 -28.5 60.67 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.238 -0.437 . . . . 71.349999999999994 111.09 179.924 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 44.2 ttm-85 -66.25 -19.09 65.72 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.216 -0.447 . . . . 73.239999999999995 110.902 -179.909 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 18.5 pttm -51.44 -30.79 20.72 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.176 -0.466 . . . . 75.040000000000006 110.888 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 14.8 ttt -52.36 -31.21 32.55 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.198 -0.455 . . . . 65.340000000000003 110.86 179.906 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 25.5 mtpp -153.11 121.14 6.13 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.277 -0.42 . . . . 74.430000000000007 110.919 179.94 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -158.95 176.73 11.95 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.241 -0.436 . . . . 74.510000000000005 110.838 179.87 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 6.6 p -52.13 158.64 1.07 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.147 -0.479 . . . . 63.310000000000002 111.175 -179.907 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 14.2 p-10 -138.16 -44.22 0.51 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.247 -0.433 . . . . 73.25 110.871 179.927 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 71.0 m -58.37 -51.59 69.18 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.178 -0.465 . . . . 74.019999999999996 110.808 -179.731 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 27.9 tt0 -52.62 -57.97 8.3 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.152 -0.476 . . . . 70.519999999999996 110.912 -179.922 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -56.41 -42.32 77.8 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.172 -0.467 . . . . 72.430000000000007 110.913 179.983 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -54.73 -35.48 63.75 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.148 -0.478 . . . . 62.340000000000003 110.854 -179.908 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 49.8 mt -74.77 -36.39 39.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.175 -0.466 . . . . 75.430000000000007 111.135 179.994 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 2.2 tpm_? -70.78 -53.58 14.91 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.15 -0.477 . . . . 74.409999999999997 110.855 179.974 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 1.6 pp20? -60.44 -39.87 89.06 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.18 -0.463 . . . . 65.450000000000003 110.894 -179.933 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -59.58 -48.51 81.39 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.148 -0.478 . . . . 61.210000000000001 111.086 179.946 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 9.1 t80 -52.08 -44.93 64.59 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.27 -0.423 . . . . 74.239999999999995 110.841 -179.87 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 6.5 tpt180 -66.38 -40.77 89.9 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.178 -0.464 . . . . 75.140000000000001 110.858 -179.91 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 92.4 t -58.4 -33.85 48.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.202 -0.454 . . . . 75.200000000000003 111.153 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 9.9 m-85 -87.52 -36.86 17.37 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.161 -0.472 . . . . 72.150000000000006 110.874 -180.0 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 17.6 t0 -61.3 96.05 0.05 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.151 -0.477 . . . . 64.239999999999995 110.847 -179.979 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 7.2 mtmp? -78.63 -52.55 8.28 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.16 -0.473 . . . . 74.209999999999994 110.924 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 32.7 p30 -75.45 -9.14 58.31 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.253 -0.431 . . . . 73.510000000000005 110.872 179.855 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 60.61 31.9 76.55 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.758 -0.734 . . . . 64.209999999999994 112.46 -179.972 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 48.6 p-10 -83.13 -16.1 48.09 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.879 0.371 . . . . 73.519999999999996 110.909 -179.931 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 86.72 18.7 57.9 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.77 -0.728 . . . . 73.510000000000005 112.489 179.99 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 6.4 m-85 -137.52 147.89 45.56 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.851 0.358 . . . . 73.349999999999994 110.942 -179.853 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 62.3 mt -112.7 112.9 42.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.117 -0.492 . . . . 74.129999999999995 111.111 179.919 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 52.0 p -107.05 -174.23 2.48 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.139 -0.482 . . . . 72.420000000000002 110.847 -179.915 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -67.71 -32.25 72.76 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.112 -0.495 . . . . 71.209999999999994 111.086 179.927 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -69.88 -45.33 67.91 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.18 -0.464 . . . . 72.129999999999995 111.098 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 18.4 mt-10 -75.32 -51.24 13.66 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.197 -0.456 . . . . 72.030000000000001 110.89 -179.942 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 47.2 tp -53.48 -43.28 68.05 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.157 -0.474 . . . . 73.219999999999999 110.925 -179.982 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 56.1 ttp180 -56.21 -49.39 74.22 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.224 -0.444 . . . . 74.439999999999998 110.903 179.931 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 80.0 t60 -54.44 -34.92 62.36 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.21 -0.45 . . . . 75.519999999999996 110.841 -179.995 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 81.0 t -67.02 -46.2 85.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.201 -0.454 . . . . 75.0 111.16 179.93 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 3.3 mmt -69.47 -25.14 63.93 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.133 -0.485 . . . . 74.450000000000003 110.885 179.923 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 7.4 m -74.12 -56.26 5.13 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.185 -0.461 . . . . 71.099999999999994 111.132 -179.891 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 6.4 t-20 -56.75 -26.79 58.21 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.234 -0.439 . . . . 73.209999999999994 110.849 -179.984 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 19.3 mt -70.74 -22.25 62.44 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.178 -0.464 . . . . 73.340000000000003 110.914 179.987 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 101.09 33.02 5.08 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.757 -0.735 . . . . 71.420000000000002 112.467 179.859 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 24.7 tp10 -110.25 163.24 13.83 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.928 0.394 . . . . 75.140000000000001 110.901 -179.889 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 48.0 mttp -116.92 103.57 10.42 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.19 -0.459 . . . . 75.219999999999999 110.904 179.958 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 17.9 mt -131.25 113.22 13.55 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.183 -0.462 . . . . 73.310000000000002 110.9 179.932 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 34.3 p -72.04 172.72 9.56 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.169 -0.469 . . . . 73.439999999999998 111.133 179.951 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 69.1 m-20 -51.91 -38.14 55.13 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.184 -0.462 . . . . 73.439999999999998 110.895 179.908 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 50.4 tp10 -71.7 -35.99 70.41 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.189 -0.46 . . . . 74.140000000000001 110.891 -179.901 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -63.55 -40.0 95.87 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.153 -0.476 . . . . 74.310000000000002 110.872 -179.93 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 60.1 t -62.72 -43.68 98.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.179 -0.464 . . . . 72.329999999999998 111.107 -179.965 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 39.8 t0 -57.06 -55.13 38.7 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.19 -0.459 . . . . 71.450000000000003 110.851 179.906 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 10.9 tm-20 -56.25 -29.28 60.86 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.157 -0.474 . . . . 72.040000000000006 110.887 -179.893 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 24.6 ttt -68.01 -59.95 2.87 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.146 -0.479 . . . . 73.540000000000006 110.853 -179.965 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 31.4 mm -53.98 -35.78 29.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.235 -0.439 . . . . 74.109999999999999 111.092 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 31.6 ttp180 -61.12 -31.73 71.42 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.2 -0.454 . . . . 74.25 110.914 179.949 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 11.8 tm-20 -72.23 -46.27 56.76 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.185 -0.461 . . . . 75.349999999999994 110.881 -179.943 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -73.37 -25.52 60.62 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.173 -0.467 . . . . 70.519999999999996 111.101 179.938 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 38.8 t0 -68.07 87.34 0.27 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.205 -0.452 . . . . 73.129999999999995 110.878 179.975 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 70.5 mt -79.91 -48.12 20.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.195 -0.457 . . . . 74.200000000000003 111.151 179.988 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 18.9 p30 -75.1 -8.65 57.14 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.183 -0.462 . . . . 75.430000000000007 110.847 179.869 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 63.99 45.18 94.64 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.742 -0.742 . . . . 54.130000000000003 112.522 -179.884 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 35.3 p-10 -92.21 -15.84 27.01 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.867 0.365 . . . . 74.549999999999997 110.882 -179.977 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 103.46 2.83 47.36 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.772 -0.728 . . . . 33.210000000000001 112.522 -179.931 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -149.22 172.23 15.18 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.871 0.367 . . . . 75.230000000000004 110.952 -179.926 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 136' ' ' VAL . . . . . . . . . . . . . 49.1 t -108.49 113.25 43.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.21 -0.45 . . . . 73.430000000000007 111.132 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 16.3 p30 -93.17 172.1 8.52 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.159 -0.473 . . . . 75.040000000000006 110.924 179.997 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 88.6 t80 -54.91 -47.33 74.49 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.212 -0.449 . . . . 74.430000000000007 110.962 -179.922 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 25.1 tt0 -51.96 -49.72 62.63 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.094 -0.503 . . . . 74.340000000000003 110.886 -179.979 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 14.7 mt-10 -66.46 -32.68 74.2 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.18 -0.464 . . . . 70.430000000000007 110.825 -179.88 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 37.5 t80 -66.33 -45.32 80.64 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.177 -0.465 . . . . 72.030000000000001 110.926 -179.952 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 66.8 t -69.53 -39.64 78.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.101 -0.499 . . . . 75.099999999999994 111.113 179.962 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 30.6 tt0 -62.28 -57.83 9.96 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.2 -0.455 . . . . 74.109999999999999 110.856 -179.964 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 11.6 tpt -56.57 -30.73 63.48 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.256 -0.429 . . . . 72.349999999999994 110.882 179.966 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 5.6 ttm -75.87 -37.22 59.13 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.219 -0.446 . . . . 72.219999999999999 110.935 179.934 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 1.9 m -97.54 21.19 10.59 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.16 -0.473 . . . . 55.240000000000002 111.158 -179.927 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -117.94 142.01 47.81 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.185 -0.462 . . . . 74.230000000000004 111.115 179.851 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 39.6 tttp . . . . . 0 C--N 1.329 -0.292 0 CA-C-N 116.205 -0.452 . . . . 73.400000000000006 110.94 179.964 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' M' M ' 8' ' ' LEU . . . . . . . . . . . . . 8.8 mp . . . . . 0 C--O 1.231 0.093 0 CA-C-O 120.853 0.358 . . . . 71.219999999999999 110.904 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' M' M ' 9' ' ' SER . . . . . . . . . . . . . 7.2 m 56.78 50.77 11.91 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.182 -0.463 . . . . 74.219999999999999 110.814 -179.923 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' M' M ' 10' ' ' GLY . . . . . . . . . . . . . . . 55.1 -153.54 11.58 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.756 -0.735 . . . . 74.230000000000004 112.444 179.97 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' M' M ' 11' ' ' GLY . . . . . . . . . . . . . . . -101.37 93.21 1.11 Allowed Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.709 -0.757 . . . . 73.439999999999998 112.453 -179.852 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' M' M ' 12' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -138.73 -171.57 3.11 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.896 0.379 . . . . 65.409999999999997 110.91 -179.911 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' M' M ' 13' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -72.27 83.51 1.04 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.178 -0.465 . . . . 74.230000000000004 110.934 -179.976 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' M' M ' 14' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -114.47 -15.91 11.99 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.209 -0.451 . . . . 74.109999999999999 110.853 179.889 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' M' M ' 15' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -51.56 -46.62 63.49 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.185 -0.461 . . . . 73.430000000000007 110.914 179.989 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' M' M ' 16' ' ' TRP . . . . . . . . . . . . . 6.1 m95 -58.1 -37.16 73.99 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.246 -0.434 . . . . 72.239999999999995 110.957 179.917 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' M' M ' 17' ' ' GLU . . . . . . . . . . . . . 11.9 tt0 -60.27 -22.06 62.64 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.24 -0.436 . . . . 74.049999999999997 110.911 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' M' M ' 18' ' ' LYS . . . . . . . . . . . . . 19.9 ttpp -65.31 -24.79 67.37 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.137 -0.483 . . . . 75.310000000000002 110.896 179.941 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' M' M ' 19' ' ' ILE . . . . . . . . . . . . . 33.1 mt -97.09 -23.14 4.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.219 -0.446 . . . . 65.430000000000007 111.088 179.927 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' M' M ' 20' ' ' ARG . . . . . . . . . . . . . 37.1 ttp85 -52.62 -36.01 55.68 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.17 -0.468 . . . . 75.400000000000006 110.87 179.986 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' M' M ' 21' ' ' LEU . . . . . . . . . . . . . 3.9 mt 59.03 -174.02 0.1 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.216 -0.447 . . . . 73.010000000000005 110.903 -179.998 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' M' M ' 22' ' ' ARG . . . . . 0.488 ' CB ' ' CD ' ' M' ' 23' ' ' PRO . 0.3 OUTLIER -179.32 -61.86 0.0 OUTLIER Pre-proline 0 C--N 1.33 -0.276 0 CA-C-O 121.662 0.744 . . . . 74.099999999999994 110.902 179.941 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' M' M ' 23' ' ' PRO . . . . . 0.488 ' CD ' ' CB ' ' M' ' 22' ' ' ARG . 53.5 Cg_endo -69.79 91.99 0.52 Allowed 'Trans proline' 0 C--N 1.342 0.199 0 C-N-CA 122.675 2.25 . . . . 72.510000000000005 112.284 -179.982 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' M' M ' 24' ' ' GLY . . . . . . . . . . . . . . . -114.54 -135.11 5.89 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.704 -0.76 . . . . 64.049999999999997 112.476 179.939 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' M' M ' 25' ' ' GLY . . . . . . . . . . . . . . . 150.09 -19.35 1.08 Allowed Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.754 -0.736 . . . . 63.229999999999997 112.489 -179.881 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' M' M ' 26' ' ' LYS . . . . . . . . . . . . . 7.9 mtpp -56.18 175.96 0.09 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.901 0.381 . . . . 75.329999999999998 110.852 -179.986 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' M' M ' 27' ' ' LYS . . . . . . . . . . . . . 6.9 ptpt -177.22 142.38 0.35 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.183 -0.462 . . . . 71.439999999999998 110.925 179.846 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' M' M ' 28' ' ' GLN . . . . . . . . . . . . . 79.5 mm-40 -150.97 165.59 33.25 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.202 -0.454 . . . . 70.310000000000002 110.895 179.999 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' M' M ' 29' ' ' TYR . . . . . . . . . . . . . 2.1 t80 -118.48 -11.01 10.01 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.212 -0.449 . . . . 74.120000000000005 110.933 -179.894 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' M' M ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 63.68 26.26 14.5 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.113 -0.494 . . . . 74.25 110.878 179.938 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' M' M ' 31' ' ' LEU . . . . . . . . . . . . . 11.8 tp -157.59 -49.89 0.07 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.259 -0.428 . . . . 72.530000000000001 110.928 179.902 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' M' M ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.43 -35.89 41.41 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.21 -0.45 . . . . 73.129999999999995 110.882 179.826 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' M' M ' 33' ' ' HIS . . . . . . . . . . . . . 13.0 t-80 -50.86 -38.72 50.96 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.189 -0.46 . . . . 64.299999999999997 110.853 179.908 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' M' M ' 34' ' ' ILE . . . . . . . . . . . . . 49.5 mm -50.03 -38.7 14.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.243 -0.435 . . . . 74.450000000000003 111.153 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' M' M ' 35' ' ' VAL . . . . . . . . . . . . . 40.9 t -50.17 -40.17 17.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.182 -0.463 . . . . 74.030000000000001 111.142 179.854 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' M' M ' 36' ' ' TRP . . . . . . . . . . . . . 20.9 m0 -59.66 -36.57 76.68 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.19 -0.459 . . . . 75.519999999999996 110.893 179.977 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' M' M ' 37' ' ' ALA . . . . . . . . . . . . . . . -63.62 -18.83 64.33 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.239 -0.437 . . . . 74.200000000000003 111.076 179.901 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' M' M ' 38' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -73.67 -17.94 61.08 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.208 -0.451 . . . . 74.310000000000002 110.858 -179.754 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' M' M ' 39' ' ' ARG . . . . . . . . . . . . . 14.2 ttt180 -55.0 -26.58 37.92 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.1 -0.5 . . . . 75.340000000000003 110.888 -179.976 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' M' M ' 40' ' ' GLU . . . . . . . . . . . . . 3.5 pt-20 -84.58 -32.21 23.91 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.166 -0.47 . . . . 74.349999999999994 110.868 -179.896 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' M' M ' 41' ' ' LEU . . . . . . . . . . . . . 11.2 mt -74.93 174.24 9.55 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.146 -0.479 . . . . 73.150000000000006 110.929 -179.985 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' M' M ' 42' ' ' GLU . . . . . . . . . . . . . 46.3 tt0 -172.16 77.98 0.05 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.231 -0.44 . . . . 75.129999999999995 110.882 179.975 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' M' M ' 43' ' ' ARG . . . . . . . . . . . . . 6.0 ptp85 . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 116.167 -0.469 . . . . 74.299999999999997 110.835 -179.887 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 241' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 262' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 301' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 322' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.09 0 CA-C-O 120.811 0.339 . . . . 72.040000000000006 111.079 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -111.44 -66.63 1.06 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.214 -0.448 . . . . 64.140000000000001 110.856 -179.993 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 25.3 pt20 -118.69 177.26 4.9 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.183 -0.462 . . . . 72.510000000000005 110.908 -179.911 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -114.95 109.33 17.96 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.195 -0.457 . . . . 71.310000000000002 110.925 179.981 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 77.7 p -102.39 176.3 5.23 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.198 -0.455 . . . . 74.430000000000007 111.137 179.971 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -57.27 -33.98 68.18 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.251 -0.431 . . . . 75.400000000000006 110.862 -179.959 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 84.7 tt0 -68.07 -38.3 82.25 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.175 -0.466 . . . . 62.420000000000002 110.894 -179.935 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 47.8 tt0 -78.01 -37.37 47.26 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.159 -0.473 . . . . 72.310000000000002 110.922 -179.956 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 52.8 mt -72.9 -40.93 60.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.183 -0.462 . . . . 74.329999999999998 111.145 179.983 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.41 -28.15 69.58 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.124 -0.489 . . . . 73.150000000000006 111.144 179.756 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 19.5 mm-40 -74.93 -52.14 11.97 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.214 -0.448 . . . . 63.539999999999999 110.88 -179.909 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 26.3 m-85 -66.89 -45.99 76.28 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.156 -0.475 . . . . 73.120000000000005 110.88 -179.919 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -52.92 -46.17 67.95 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.143 -0.48 . . . . 72.5 110.931 179.948 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -54.93 -30.84 59.54 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.188 -0.46 . . . . 73.230000000000004 110.868 -179.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -69.52 -45.29 69.18 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.172 -0.467 . . . . 73.120000000000005 111.08 179.933 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 85.5 t80 -54.75 -54.26 44.31 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.191 -0.459 . . . . 75.329999999999998 110.903 -179.906 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 10.6 t -61.58 -26.38 67.93 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.15 -0.477 . . . . 61.119999999999997 110.902 -179.806 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 2.9 tt -65.31 -40.03 93.23 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.104 -0.498 . . . . 72.439999999999998 110.911 -179.994 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 36.1 m-85 -77.6 -34.62 53.39 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.147 -0.478 . . . . 73.019999999999996 110.881 179.965 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 15.9 t0 -67.21 98.57 0.62 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.134 -0.484 . . . . 61.240000000000002 110.892 179.998 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 23.3 mmtp -72.06 -56.46 5.58 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.226 -0.443 . . . . 70.150000000000006 110.893 -179.994 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 17.1 p-10 -71.01 -10.24 59.4 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.19 -0.459 . . . . 72.010000000000005 110.877 179.859 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 51.54 71.21 0.69 Allowed Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.751 -0.738 . . . . 75.230000000000004 112.438 -179.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 22.7 p-10 -114.52 -15.75 11.99 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.874 0.368 . . . . 72.420000000000002 110.884 179.995 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 101.21 12.37 36.48 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.718 -0.753 . . . . 71.25 112.484 -179.926 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 1.9 p -154.66 144.47 21.62 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.743 0.306 . . . . 74.430000000000007 111.133 -179.853 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 22.2 mt -102.93 114.46 42.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.237 -0.438 . . . . 71.219999999999999 111.109 179.934 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 19.2 p -102.06 174.91 5.72 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.146 -0.479 . . . . 74.329999999999998 111.172 179.945 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 69.9 p -61.0 -29.97 70.01 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.198 -0.455 . . . . 72.040000000000006 111.149 -179.979 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 32.3 mtmt -79.89 -50.12 10.93 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.258 -0.428 . . . . 74.329999999999998 110.841 179.96 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 -63.34 -35.91 81.95 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.234 -0.439 . . . . 73.319999999999993 110.919 179.981 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.0 tt -74.25 -52.2 13.06 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.121 -0.49 . . . . 75.430000000000007 110.927 179.983 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -52.17 -29.2 28.48 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.782 -0.723 . . . . 52.219999999999999 112.477 179.928 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 95.5 m -66.07 -58.91 4.42 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.853 0.359 . . . . 64.420000000000002 111.125 -179.828 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 94.2 t -54.39 -45.95 69.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.216 -0.447 . . . . 72.140000000000001 111.141 179.902 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 1.9 mmm -52.18 -38.24 57.2 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.198 -0.455 . . . . 73.209999999999994 110.858 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 3.8 tmt_? -55.55 -52.74 62.72 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.214 -0.448 . . . . 72.299999999999997 110.921 -179.95 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 5.9 t -59.89 -29.74 68.53 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.184 -0.462 . . . . 74.140000000000001 110.889 -179.813 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 48.2 mt -80.26 -21.46 42.72 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.099 -0.5 . . . . 74.040000000000006 110.93 179.957 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 101.46 31.02 5.68 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.754 -0.736 . . . . 63.219999999999999 112.448 179.868 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -127.4 113.45 16.24 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.814 0.34 . . . . 73.530000000000001 110.917 -179.924 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 32.3 t-20 -109.87 81.22 1.95 Allowed Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.628 0.728 . . . . 73.329999999999998 110.857 -179.96 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.72 167.95 22.92 Favored 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.673 2.249 . . . . 73.510000000000005 112.395 179.887 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 20.2 p -98.44 157.46 16.2 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.239 -0.437 . . . . 63.329999999999998 111.153 -179.97 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -52.02 -45.19 64.49 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.245 -0.434 . . . . 74.540000000000006 110.834 -179.952 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -71.07 -31.65 68.1 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.209 -0.45 . . . . 73.310000000000002 111.124 179.914 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -66.67 -49.19 66.94 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.206 -0.452 . . . . 73.109999999999999 110.871 -179.914 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 16.3 mt -55.17 -50.65 68.77 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.142 -0.481 . . . . 74.430000000000007 110.936 -179.96 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 24.6 tp60 -60.19 -28.6 68.1 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.155 -0.475 . . . . 73.439999999999998 110.947 179.919 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 45.4 t0 -74.18 -49.8 21.97 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.19 -0.459 . . . . 71.340000000000003 110.87 -179.99 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 15.6 ptm -66.95 -41.65 86.58 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.153 -0.476 . . . . 75.319999999999993 110.926 179.974 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 96.9 mt -66.76 -37.95 80.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.204 -0.453 . . . . 74.299999999999997 111.15 179.931 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 37.9 m-20 -63.2 -24.9 68.09 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.143 -0.48 . . . . 64.010000000000005 110.842 179.982 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 15.9 mm-40 -73.09 -41.2 64.33 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.194 -0.457 . . . . 74.209999999999994 110.886 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 32.6 m -86.37 -17.5 9.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.134 -0.485 . . . . 74.409999999999997 111.138 179.991 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 39.0 t0 -66.84 94.1 0.3 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.146 -0.479 . . . . 74.549999999999997 110.825 179.978 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.3 -29.79 20.11 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.183 -0.462 . . . . 71.209999999999994 111.037 179.974 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -92.86 -0.19 57.29 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.256 -0.429 . . . . 70.150000000000006 110.874 -179.976 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 52.18 60.11 8.07 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.739 -0.743 . . . . 61.210000000000001 112.498 -179.922 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 44.8 p-10 -114.43 -15.88 12.01 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.896 0.379 . . . . 64.409999999999997 110.902 -179.911 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 96.22 8.34 57.77 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.724 -0.75 . . . . 72.209999999999994 112.436 179.947 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 71.9 p -150.61 175.11 12.24 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.772 0.32 . . . . 73.209999999999994 111.131 -179.853 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 19.3 mt -101.67 115.6 43.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.204 -0.453 . . . . 65.129999999999995 111.146 179.874 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 27.4 m-20 -78.46 -172.88 3.08 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.155 -0.475 . . . . 61.310000000000002 110.905 179.837 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.514 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 2.5 t80 -64.83 -58.37 13.28 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 121.632 0.73 . . . . 74.230000000000004 110.847 -179.838 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . 0.514 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 54.1 Cg_endo -69.75 -31.01 21.41 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.674 2.249 . . . . 74.310000000000002 112.34 -179.997 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 19.9 mt-10 -57.45 -41.86 81.37 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.2 -0.455 . . . . 73.519999999999996 110.863 -179.942 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 10.6 t80 -73.93 -36.07 64.65 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.174 -0.467 . . . . 73.230000000000004 110.908 -179.921 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 16.8 tp -66.68 -53.92 28.67 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.146 -0.479 . . . . 75.430000000000007 110.878 -179.986 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 15.3 t -56.21 -31.23 63.3 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.2 -0.455 . . . . 74.310000000000002 111.117 179.962 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 41.4 ttp -60.05 -50.37 73.99 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.237 -0.438 . . . . 73.439999999999998 110.848 179.95 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -52.83 -44.67 66.88 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.257 -0.429 . . . . 73.25 110.901 179.93 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -72.42 -28.41 62.95 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.189 -0.46 . . . . 63.530000000000001 111.104 179.937 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 9.0 ttm-85 -63.82 -16.79 62.14 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.176 -0.465 . . . . 75.420000000000002 110.873 -179.893 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -55.44 -20.8 13.56 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.204 -0.453 . . . . 73.409999999999997 110.881 179.936 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 3.8 ttt -54.18 -60.65 3.06 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.264 -0.426 . . . . 75.340000000000003 110.902 179.843 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 58.6 mttt -151.15 -171.93 4.07 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.255 -0.43 . . . . 75.420000000000002 110.951 179.945 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 63.5 57.54 1.46 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.234 -0.439 . . . . 73.140000000000001 110.857 179.873 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 2.9 m -161.29 128.53 4.09 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.157 -0.474 . . . . 73.209999999999994 111.124 -179.911 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -173.51 -38.47 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.21 -0.45 . . . . 62.200000000000003 110.878 179.932 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 20.1 m -58.44 -27.48 64.4 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.213 -0.449 . . . . 65.150000000000006 110.861 -179.768 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 15.4 mm-40 -98.81 -45.52 5.98 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.18 -0.464 . . . . 73.329999999999998 110.92 -179.969 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 -59.69 -38.17 80.83 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.128 -0.487 . . . . 74.209999999999994 110.884 -179.94 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 16.5 tp10 -60.48 -43.24 97.17 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.144 -0.48 . . . . 74.049999999999997 110.886 -179.906 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 32.4 mt -75.19 -51.01 22.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.13 -0.486 . . . . 63.399999999999999 111.108 179.976 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 2.3 tmt_? -56.26 -53.63 54.95 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.187 -0.461 . . . . 72.230000000000004 110.856 -179.987 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 11.7 tm-20 -56.77 -56.08 26.06 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.173 -0.467 . . . . 75.049999999999997 110.885 -179.948 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -53.33 -50.93 63.97 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.204 -0.453 . . . . 65.030000000000001 111.113 179.921 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 5.1 t80 -61.03 -35.15 76.14 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.237 -0.438 . . . . 74.430000000000007 110.832 -179.888 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 14.8 ttt-85 -72.42 -27.48 62.36 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.136 -0.484 . . . . 74.239999999999995 110.911 -179.928 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 86.2 t -75.12 -28.02 20.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.176 -0.465 . . . . 75.120000000000005 111.14 179.98 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 8.7 m-85 -95.72 -30.34 13.79 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.152 -0.476 . . . . 75.030000000000001 110.872 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 43.7 t0 -76.68 89.41 3.36 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.168 -0.469 . . . . 72.319999999999993 110.883 179.995 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 34.0 mmtt -78.02 -48.77 15.41 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.185 -0.461 . . . . 70.349999999999994 110.929 179.982 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 9.5 p30 -72.58 -9.09 58.16 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.237 -0.438 . . . . 74.109999999999999 110.841 179.903 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 60.04 28.83 66.95 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.7 -0.762 . . . . 65.239999999999995 112.504 -179.933 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 43.8 p-10 -81.89 -16.1 51.77 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.89 0.376 . . . . 73.530000000000001 110.915 -179.885 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 82.36 18.72 65.93 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.746 -0.74 . . . . 44.140000000000001 112.5 179.966 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 19.0 m-85 -137.56 136.63 37.78 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.849 0.357 . . . . 54.030000000000001 110.917 -179.76 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 79.9 mt -106.05 124.94 61.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.141 -0.482 . . . . 72.129999999999995 111.112 179.939 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 40.2 p -116.45 176.22 5.21 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.175 -0.466 . . . . 72.310000000000002 110.883 -179.945 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -60.28 -38.88 84.95 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.12 -0.491 . . . . 65.549999999999997 111.13 179.881 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -62.42 -39.6 93.83 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.211 -0.449 . . . . 63.109999999999999 111.074 179.933 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 54.6 mt-10 -73.46 -51.56 16.76 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.207 -0.451 . . . . 73.439999999999998 110.874 -179.926 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 17.2 tp -56.2 -44.52 79.54 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.195 -0.457 . . . . 73.040000000000006 110.918 -179.955 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 27.5 ttt180 -52.59 -49.2 65.48 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.211 -0.45 . . . . 72.450000000000003 110.832 179.958 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 81.0 t60 -65.57 -34.81 79.11 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.18 -0.463 . . . . 74.319999999999993 110.86 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 91.2 t -59.18 -52.28 62.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.229 -0.442 . . . . 73.450000000000003 111.145 179.974 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 2.2 tpt -56.16 -36.35 68.21 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.19 -0.459 . . . . 72.209999999999994 110.875 179.893 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -53.56 -35.26 60.58 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.261 -0.427 . . . . 71.409999999999997 111.129 -179.917 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 5.2 t30 -74.53 -26.57 60.06 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.197 -0.456 . . . . 74.209999999999994 110.897 -179.985 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 15.4 mt -77.73 -25.37 49.25 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.141 -0.481 . . . . 75.099999999999994 110.894 179.976 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 101.07 32.97 5.11 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.716 -0.754 . . . . 62.32 112.498 179.877 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 21.2 mm-40 -129.43 110.11 11.62 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.931 0.396 . . . . 75.129999999999995 110.85 -179.852 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 20.8 pttp -72.59 135.83 45.63 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.104 -0.498 . . . . 74.409999999999997 110.901 179.961 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 75.0 mt -138.23 157.57 46.02 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.259 -0.428 . . . . 71.019999999999996 110.894 179.914 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 69.6 p -107.74 163.26 13.25 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.184 -0.462 . . . . 72.540000000000006 111.146 179.959 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 14.2 m-20 -52.12 -40.87 61.96 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.219 -0.446 . . . . 53.409999999999997 110.844 179.913 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 59.7 tt0 -72.98 -33.52 65.88 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.185 -0.461 . . . . 74.129999999999995 110.898 -179.881 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -66.5 -44.33 82.85 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.109 -0.496 . . . . 73.549999999999997 110.904 -179.953 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 91.1 t -57.81 -31.07 39.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.152 -0.476 . . . . 73.420000000000002 111.08 -179.994 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 19.0 t0 -59.62 -45.39 92.08 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.235 -0.439 . . . . 74.140000000000001 110.859 179.928 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -55.81 -30.3 61.15 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.182 -0.463 . . . . 73.019999999999996 110.888 -179.909 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 4.3 mtt -76.01 -59.41 2.77 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.111 -0.495 . . . . 73.120000000000005 110.929 179.956 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 36.1 mm -53.99 -35.5 28.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.234 -0.439 . . . . 75.400000000000006 111.138 179.973 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 52.8 ttt85 -63.01 -31.79 73.01 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.178 -0.464 . . . . 75.25 110.875 179.944 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 31.7 tp10 -75.14 -52.44 10.99 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.164 -0.471 . . . . 72.319999999999993 110.895 -179.912 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -64.86 -34.47 78.46 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.149 -0.478 . . . . 75.129999999999995 111.119 179.889 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 48.7 t0 -68.46 86.93 0.3 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.219 -0.446 . . . . 74.329999999999998 110.861 -179.973 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 7.8 mt -79.97 -46.88 22.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.184 -0.462 . . . . 75.450000000000003 111.108 -179.984 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 21.1 p30 -72.47 -8.84 57.18 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.199 -0.455 . . . . 74.510000000000005 110.908 179.836 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 63.15 44.47 97.12 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.767 -0.73 . . . . 72.25 112.476 -179.97 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 35.5 p-10 -90.67 -15.95 29.45 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.86 0.362 . . . . 60.329999999999998 110.883 -179.948 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 102.79 3.02 49.54 Favored Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 120.75 -0.738 . . . . 73.420000000000002 112.492 -179.96 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 5.3 tt0 -149.27 172.3 15.09 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.824 0.345 . . . . 75.120000000000005 110.932 -179.925 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 136' ' ' VAL . . . . . . . . . . . . . 60.0 t -112.03 109.1 27.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.236 -0.438 . . . . 71.340000000000003 111.133 179.991 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 17.2 p30 -90.52 173.04 8.29 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.205 -0.452 . . . . 74.109999999999999 110.916 179.985 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 55.4 t80 -58.75 -47.44 84.64 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.213 -0.449 . . . . 72.140000000000001 110.94 -179.926 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 78.4 tt0 -51.89 -39.69 59.44 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.095 -0.502 . . . . 73.349999999999994 110.929 179.986 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 89.6 mt-10 -78.09 -38.31 44.45 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.135 -0.484 . . . . 73.239999999999995 110.876 -179.938 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 51.7 t80 -63.19 -35.55 80.69 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.195 -0.457 . . . . 74.420000000000002 110.841 -179.93 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 99.5 t -64.43 -44.43 97.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.149 -0.478 . . . . 75.150000000000006 111.138 -179.99 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 14.5 tt0 -74.03 -30.49 62.46 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.138 -0.483 . . . . 73.329999999999998 110.901 -179.993 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 6.9 tpt -73.1 -30.68 63.84 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.177 -0.465 . . . . 74.310000000000002 110.88 -179.999 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -82.48 -26.22 32.8 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.241 -0.436 . . . . 73.340000000000003 110.865 179.954 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 87.3 m -85.3 -25.64 27.08 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.217 -0.447 . . . . 73.439999999999998 111.172 -179.927 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -60.42 115.73 3.78 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.23 -0.441 . . . . 75.25 111.072 179.863 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 52.6 tttm . . . . . 0 C--N 1.329 -0.297 0 CA-C-N 116.225 -0.443 . . . . 75.439999999999998 110.911 179.968 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' M' M ' 8' ' ' LEU . . . . . . . . . . . . . 18.9 mt . . . . . 0 C--O 1.23 0.076 0 CA-C-O 120.859 0.361 . . . . 75.109999999999999 110.896 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' M' M ' 9' ' ' SER . . . . . . . . . . . . . 5.2 p -123.48 178.78 5.02 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.176 -0.465 . . . . 62.399999999999999 110.891 -179.99 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' M' M ' 10' ' ' GLY . . . . . . . . . . . . . . . -165.34 -119.63 0.49 Allowed Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.739 -0.743 . . . . 74.409999999999997 112.48 -179.938 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' M' M ' 11' ' ' GLY . . . . . . . . . . . . . . . -80.16 -42.01 11.28 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.738 -0.744 . . . . 52.210000000000001 112.463 -179.898 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' M' M ' 12' ' ' GLU . . . . . . . . . . . . . 5.5 pt-20 -110.78 -174.68 2.53 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.865 0.364 . . . . 74.329999999999998 110.916 -179.919 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' M' M ' 13' ' ' LEU . . . . . . . . . . . . . 2.5 tt -88.52 129.22 35.51 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.151 -0.477 . . . . 71.109999999999999 110.912 -179.962 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' M' M ' 14' ' ' ASP . . . . . . . . . . . . . 34.6 t0 -79.51 58.77 2.77 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.131 -0.486 . . . . 53.25 110.846 179.882 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' M' M ' 15' ' ' LYS . . . . . . . . . . . . . 12.8 mttm -67.48 -43.12 81.73 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.185 -0.461 . . . . 65.430000000000007 110.87 179.992 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' M' M ' 16' ' ' TRP . . . . . . . . . . . . . 7.8 m95 -51.79 -46.63 64.26 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.21 -0.45 . . . . 71.409999999999997 110.906 179.957 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' M' M ' 17' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -56.17 -28.44 58.1 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.262 -0.426 . . . . 74.140000000000001 110.882 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' M' M ' 18' ' ' LYS . . . . . . . . . . . . . 6.2 ttpm? -76.7 -26.01 54.24 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.15 -0.477 . . . . 74.540000000000006 110.883 179.98 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' M' M ' 19' ' ' ILE . . . . . . . . . . . . . 76.6 mt -79.35 -22.66 12.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.259 -0.428 . . . . 73.209999999999994 111.126 179.871 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' M' M ' 20' ' ' ARG . . . . . . . . . . . . . 47.7 ttp85 -68.79 -28.21 66.57 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.188 -0.46 . . . . 75.239999999999995 110.874 179.993 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' M' M ' 21' ' ' LEU . . . . . . . . . . . . . 6.8 mt 63.23 -169.94 0.18 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.178 -0.464 . . . . 75.120000000000005 110.898 -179.96 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' M' M ' 22' ' ' ARG . . . . . . . . . . . . . 7.2 mmt85 -106.95 158.8 32.01 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.65 0.738 . . . . 75.510000000000005 110.821 179.963 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' M' M ' 23' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.73 90.81 0.51 Allowed 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.716 2.277 . . . . 70.109999999999999 112.318 -179.987 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' M' M ' 24' ' ' GLY . . . . . . . . . . . . . . . 172.24 118.31 0.48 Allowed Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.786 -0.721 . . . . 62.229999999999997 112.534 179.991 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' M' M ' 25' ' ' GLY . . . . . . . . . . . . . . . 173.47 -151.9 14.45 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.778 -0.725 . . . . 71.340000000000003 112.518 -179.923 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' M' M ' 26' ' ' LYS . . . . . . . . . . . . . 11.3 mmtp -52.09 164.93 0.24 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.831 0.348 . . . . 75.030000000000001 110.917 179.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' M' M ' 27' ' ' LYS . . . . . . . . . . . . . 31.4 mtmm -148.42 103.04 3.39 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.26 -0.427 . . . . 73.219999999999999 110.894 179.849 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' M' M ' 28' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 -177.0 141.46 0.34 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.204 -0.453 . . . . 74.150000000000006 110.912 179.964 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' M' M ' 29' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -51.99 149.43 5.06 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.207 -0.451 . . . . 75.549999999999997 110.918 -179.861 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' M' M ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.22 23.73 5.55 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.105 -0.498 . . . . 65.310000000000002 110.898 179.879 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' M' M ' 31' ' ' LEU . . . . . . . . . . . . . 19.6 tp -130.08 -44.33 1.16 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.24 -0.437 . . . . 74.400000000000006 110.905 179.899 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' M' M ' 32' ' ' LYS . . . . . . . . . . . . . 3.2 tttt -49.15 -43.71 42.02 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.201 -0.454 . . . . 73.540000000000006 110.925 179.849 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' M' M ' 33' ' ' HIS . . . . . . . . . . . . . 11.9 t60 -50.92 -39.01 53.63 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.227 -0.442 . . . . 72.230000000000004 110.841 179.853 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' M' M ' 34' ' ' ILE . . . . . . . . . . . . . 50.3 mm -51.26 -38.18 19.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.24 -0.436 . . . . 72.430000000000007 111.151 179.994 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' M' M ' 35' ' ' VAL . . . . . . . . . . . . . 44.1 t -48.88 -38.84 10.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.2 -0.454 . . . . 74.209999999999994 111.18 179.819 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' M' M ' 36' ' ' TRP . . . . . . . . . . . . . 20.1 m0 -58.46 -40.31 82.32 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.154 -0.475 . . . . 70.310000000000002 110.871 179.975 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' M' M ' 37' ' ' ALA . . . . . . . . . . . . . . . -63.89 -18.85 64.6 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.283 -0.417 . . . . 72.109999999999999 111.089 179.891 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' M' M ' 38' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -81.39 -17.79 47.76 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.215 -0.448 . . . . 75.030000000000001 110.882 -179.763 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' M' M ' 39' ' ' ARG . . . . . . . . . . . . . 20.3 ttt-85 -54.99 -26.63 38.12 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.129 -0.487 . . . . 74.099999999999994 110.906 -179.975 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' M' M ' 40' ' ' GLU . . . . . . . . . . . . . 71.9 mt-10 -87.35 -45.69 10.34 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.166 -0.47 . . . . 74.120000000000005 110.892 -179.948 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' M' M ' 41' ' ' LEU . . . . . . . . . . . . . 10.7 mt -52.77 110.28 0.5 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.153 -0.476 . . . . 74.439999999999998 110.92 179.994 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' M' M ' 42' ' ' GLU . . . . . . . . . . . . . 29.5 mt-10 52.27 79.66 0.11 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.163 -0.471 . . . . 72.319999999999993 110.898 179.951 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' M' M ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.328 0 CA-C-N 116.191 -0.459 . . . . 74.120000000000005 110.917 -179.952 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 241' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 262' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 301' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 322' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.101 0 CA-C-O 120.738 0.304 . . . . 74.439999999999998 111.135 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 59.24 83.9 0.12 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.227 -0.442 . . . . 73.430000000000007 110.88 179.98 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 12.8 mp0 -54.43 -71.51 0.08 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.17 -0.468 . . . . 75.140000000000001 110.896 -179.88 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -83.81 109.32 17.44 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.198 -0.455 . . . . 72.099999999999994 110.935 179.984 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 41.2 p -97.1 174.08 6.93 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.189 -0.46 . . . . 73.209999999999994 111.167 179.944 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 15.9 tm-20 -56.33 -37.83 70.49 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.254 -0.43 . . . . 63.030000000000001 110.879 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 47.1 tt0 -67.63 -33.72 75.55 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.172 -0.467 . . . . 73.310000000000002 110.851 -179.907 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 9.1 tp-100 -78.03 -42.41 32.55 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.166 -0.47 . . . . 74.519999999999996 110.92 -179.905 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 59.5 mt -70.84 -45.48 73.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.161 -0.472 . . . . 72.140000000000001 111.125 179.969 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -54.73 -29.01 52.43 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.168 -0.469 . . . . 72.120000000000005 111.089 179.845 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 34.7 mm-40 -74.58 -52.23 12.37 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.212 -0.449 . . . . 71.340000000000003 110.915 -179.923 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 24.5 m-85 -63.05 -46.01 89.52 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.142 -0.481 . . . . 74.120000000000005 110.871 -179.924 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 2.5 tmtm? -54.69 -34.8 62.85 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.154 -0.475 . . . . 74.140000000000001 110.889 179.97 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 49.1 tt0 -64.91 -33.32 75.75 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.2 -0.455 . . . . 61.140000000000001 110.852 -179.994 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -66.8 -41.35 87.75 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.177 -0.465 . . . . 71.120000000000005 111.106 179.945 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 88.8 t80 -61.5 -54.28 45.29 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.194 -0.457 . . . . 74.329999999999998 110.877 -179.929 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 22.6 t -57.19 -26.45 60.66 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.15 -0.477 . . . . 62.100000000000001 110.858 -179.785 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 15.3 tp -66.85 -44.32 81.35 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.136 -0.484 . . . . 75.319999999999993 110.921 -179.955 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 36.8 m-85 -74.61 -30.79 61.79 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.166 -0.47 . . . . 73.200000000000003 110.876 179.924 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 17.9 t0 -72.73 98.69 2.44 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.114 -0.494 . . . . 63.43 110.878 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 19.3 mtpp -68.97 -53.3 21.41 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.147 -0.479 . . . . 75.439999999999998 110.93 179.961 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 20.8 p-10 -74.18 -10.47 59.64 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.184 -0.462 . . . . 71.519999999999996 110.856 179.876 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 50.94 43.6 49.19 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.719 -0.753 . . . . 72.430000000000007 112.504 -179.918 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 35.7 p-10 -88.04 -15.61 35.88 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.824 0.345 . . . . 54.509999999999998 110.856 -179.966 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 105.38 -11.58 47.38 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.727 -0.749 . . . . 63.130000000000003 112.511 -179.922 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 9.9 p -132.99 130.7 39.84 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.764 0.316 . . . . 74.129999999999995 111.13 -179.891 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 22.2 mt -86.6 122.7 39.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.203 -0.453 . . . . 72.409999999999997 111.168 179.898 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 81.6 p -98.28 176.94 5.53 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.199 -0.455 . . . . 74.129999999999995 111.14 179.98 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 62.4 p -65.22 -45.05 86.27 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.222 -0.445 . . . . 71.120000000000005 111.147 -179.98 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 21.2 mtmm -64.22 -42.83 96.4 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.219 -0.446 . . . . 75.239999999999995 110.858 179.91 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -67.48 -32.7 73.72 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.248 -0.433 . . . . 72.519999999999996 110.844 -179.992 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -68.35 -44.73 74.62 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.191 -0.459 . . . . 74.230000000000004 110.934 -179.95 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -71.76 -27.87 70.06 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.722 -0.752 . . . . 52.009999999999998 112.482 179.875 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 94.5 m -63.95 -54.22 37.96 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.808 0.337 . . . . 75.010000000000005 111.211 -179.889 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 47.2 t -58.18 -53.29 47.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.173 -0.467 . . . . 72.340000000000003 111.138 179.882 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 2.2 mtt -52.01 -36.61 50.52 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.181 -0.463 . . . . 75.420000000000002 110.856 179.938 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 34.5 ttt-85 -54.1 -46.7 72.15 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.204 -0.453 . . . . 74.409999999999997 110.859 -179.917 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 3.1 t -68.81 -26.2 65.06 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.201 -0.454 . . . . 74.319999999999993 110.892 -179.805 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 39.0 mt -82.73 -18.16 41.77 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.114 -0.494 . . . . 73.010000000000005 110.918 179.974 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 101.55 28.61 6.62 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.76 -0.733 . . . . 61.130000000000003 112.496 179.924 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 8.1 mm100 -116.7 123.26 46.79 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.801 0.334 . . . . 71.120000000000005 110.923 -179.89 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 32.5 t-20 -109.91 76.76 1.0 Allowed Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 121.638 0.732 . . . . 71.549999999999997 110.876 -179.929 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.7 168.06 22.58 Favored 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.672 2.248 . . . . 65.299999999999997 112.314 179.939 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 19.5 p -112.77 154.09 26.76 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.177 -0.465 . . . . 71.120000000000005 111.118 -179.951 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 12.3 tp10 -51.96 -38.81 57.88 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.23 -0.441 . . . . 73.549999999999997 110.831 -179.991 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.34 -31.5 64.01 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.167 -0.47 . . . . 74.310000000000002 111.05 179.974 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 21.4 tt0 -72.94 -52.7 13.57 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.246 -0.434 . . . . 75.340000000000003 110.893 -179.924 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 34.6 mt -56.07 -49.14 74.61 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.145 -0.48 . . . . 74.439999999999998 110.893 -179.942 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 12.8 tp60 -56.86 -29.01 62.51 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.207 -0.451 . . . . 72.5 110.923 179.909 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -75.5 -49.66 18.08 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.168 -0.469 . . . . 75.230000000000004 110.891 179.966 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 32.6 mtp -60.61 -54.84 40.54 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.211 -0.45 . . . . 72.129999999999995 110.895 179.956 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 65.9 mt -53.18 -42.83 47.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.264 -0.425 . . . . 65.109999999999999 111.123 179.934 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 76.0 m-20 -71.21 -27.09 63.24 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.204 -0.453 . . . . 61.329999999999998 110.865 179.974 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 10.8 tt0 -67.89 -28.95 67.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.195 -0.457 . . . . 73.319999999999993 110.893 179.994 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 3.4 m -112.03 16.92 7.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.155 -0.475 . . . . 62.219999999999999 111.133 179.951 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 28.8 t0 -88.89 99.55 12.49 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.198 -0.456 . . . . 73.439999999999998 110.854 179.908 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.3 -37.72 15.76 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.148 -0.478 . . . . 73.25 111.082 179.942 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -88.66 -0.32 57.17 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.222 -0.445 . . . . 62.399999999999999 110.866 179.981 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 51.37 57.89 10.93 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.746 -0.74 . . . . 70.129999999999995 112.466 -179.963 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 48.8 p-10 -114.56 -15.73 11.97 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.884 0.373 . . . . 73.150000000000006 110.894 -179.896 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 89.84 19.22 48.48 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.777 -0.725 . . . . 53.509999999999998 112.546 179.985 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 44.3 p -148.34 168.28 23.02 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.764 0.316 . . . . 74.340000000000003 111.144 -179.885 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 13.3 mm -100.93 109.48 25.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.214 -0.448 . . . . 74.140000000000001 111.15 179.894 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -76.2 -173.49 2.43 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.193 -0.458 . . . . 73.530000000000001 110.848 179.902 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.51 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 2.5 t80 -64.57 -58.51 13.27 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-O 121.651 0.738 . . . . 74.329999999999998 110.861 -179.895 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . 0.51 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 54.5 Cg_endo -69.69 -30.34 22.77 Favored 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 122.699 2.266 . . . . 65.310000000000002 112.38 179.981 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 18.1 mt-10 -57.17 -40.78 77.99 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.221 -0.445 . . . . 74.25 110.847 -179.957 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 12.5 t80 -74.11 -36.1 64.2 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.143 -0.48 . . . . 72.120000000000005 110.898 -179.918 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 29.0 tp -67.28 -53.74 27.14 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.137 -0.483 . . . . 75.120000000000005 110.935 -179.942 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 12.6 t -53.13 -27.56 21.43 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.173 -0.467 . . . . 73.310000000000002 111.101 179.941 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 56.1 ttp -67.51 -42.72 82.35 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.24 -0.436 . . . . 74.310000000000002 110.891 179.919 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 2.7 mtt -79.82 -31.71 40.62 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.214 -0.448 . . . . 71.030000000000001 110.863 179.998 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -66.52 -35.34 80.02 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.23 -0.441 . . . . 64.230000000000004 111.103 179.877 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 41.7 ttt180 -56.24 -25.26 47.04 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.236 -0.438 . . . . 71.230000000000004 110.866 -179.882 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -68.84 -35.31 76.8 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.195 -0.457 . . . . 74.209999999999994 110.908 179.928 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 4.5 tpt -56.08 -42.3 76.47 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.233 -0.44 . . . . 74.329999999999998 110.894 179.869 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 33.8 ttpt -68.58 113.2 5.88 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.205 -0.452 . . . . 74.319999999999993 110.913 179.948 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -152.71 166.73 31.26 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.242 -0.436 . . . . 74.099999999999994 110.828 179.897 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 3.5 m -103.94 -42.69 5.5 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.174 -0.466 . . . . 75.109999999999999 111.133 -179.889 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -55.03 -30.99 60.71 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.185 -0.462 . . . . 75.140000000000001 110.855 179.917 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 1.6 t -55.57 -37.42 68.02 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.172 -0.467 . . . . 75.219999999999999 110.874 -179.779 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 8.5 tt0 -52.92 -33.07 48.89 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.149 -0.478 . . . . 72.329999999999998 110.897 -179.979 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 4.2 tm-20 -67.65 -48.25 67.22 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.154 -0.475 . . . . 64.349999999999994 110.894 -179.898 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -59.3 -26.66 65.17 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.132 -0.486 . . . . 74.5 110.908 -179.989 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 58.2 mt -74.04 -51.13 25.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.165 -0.471 . . . . 75.319999999999993 111.135 179.959 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 13.5 ttt85 -61.7 -28.21 69.25 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.157 -0.474 . . . . 74.219999999999999 110.887 179.982 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 17.5 tt0 -67.36 -58.01 5.58 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.199 -0.455 . . . . 75.030000000000001 110.886 -179.941 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -59.52 -47.38 85.76 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.196 -0.457 . . . . 54.310000000000002 111.086 179.927 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -52.03 -43.89 63.95 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.181 -0.463 . . . . 74.530000000000001 110.866 -179.878 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 60.8 ttt180 -69.53 -32.19 70.87 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.135 -0.484 . . . . 73.319999999999993 110.899 -179.917 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 90.8 t -68.5 -27.76 37.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.172 -0.467 . . . . 72.409999999999997 111.13 179.957 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 9.1 m-85 -93.68 -33.33 13.69 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.198 -0.455 . . . . 74.519999999999996 110.904 179.994 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 25.8 t0 -64.25 96.75 0.16 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.159 -0.473 . . . . 75.209999999999994 110.874 179.965 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 7.4 tppt? -78.72 -53.21 7.38 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.16 -0.473 . . . . 75.200000000000003 110.914 -179.992 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 56.4 p-10 -72.85 -9.07 58.26 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.249 -0.432 . . . . 75.510000000000005 110.891 179.848 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 59.63 26.68 62.73 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.772 -0.727 . . . . 63.450000000000003 112.448 -179.981 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 39.3 p-10 -81.8 -16.14 51.91 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.869 0.366 . . . . 63.420000000000002 110.895 -179.864 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 88.48 18.72 54.53 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.727 -0.749 . . . . 74.299999999999997 112.441 179.946 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 19.0 m-85 -140.52 150.19 43.41 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.889 0.376 . . . . 74.310000000000002 110.944 -179.823 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 62.3 mt -120.98 133.48 67.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.111 -0.495 . . . . 71.109999999999999 111.157 179.907 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 97.8 p -114.44 177.74 4.53 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.174 -0.466 . . . . 72.540000000000006 110.897 -179.896 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -60.66 -34.54 74.45 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.201 -0.454 . . . . 72.099999999999994 111.081 179.927 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -71.9 -49.33 38.78 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.279 -0.419 . . . . 73.120000000000005 111.093 179.966 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 17.4 mt-10 -63.01 -46.52 87.27 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.202 -0.454 . . . . 72.150000000000006 110.893 -179.922 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 26.4 tp -52.98 -42.7 65.79 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.137 -0.483 . . . . 74.099999999999994 110.887 -179.977 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 5.9 ttt-85 -62.13 -34.95 77.33 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.219 -0.446 . . . . 74.400000000000006 110.873 179.952 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 16.5 t60 -58.52 -34.9 71.48 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.175 -0.466 . . . . 74.439999999999998 110.871 179.998 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 58.0 t -70.99 -39.17 74.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.242 -0.435 . . . . 71.109999999999999 111.084 -179.99 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 5.1 mmt -76.43 -26.67 55.73 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.229 -0.441 . . . . 75.540000000000006 110.885 179.917 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 40.4 m -71.66 -56.04 6.57 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.221 -0.445 . . . . 74.239999999999995 111.164 -179.952 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -56.09 -31.16 62.99 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.219 -0.446 . . . . 72.120000000000005 110.921 179.956 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 3.2 mt -71.46 -25.86 62.47 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.137 -0.483 . . . . 73.439999999999998 110.931 179.982 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 100.95 33.01 5.13 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.777 -0.725 . . . . 74.25 112.508 179.933 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 29.6 tp10 -110.08 110.18 20.98 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.932 0.396 . . . . 75.230000000000004 110.875 -179.896 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 30.9 mttm -60.79 102.68 0.2 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.124 -0.489 . . . . 74.219999999999999 110.894 179.984 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 81.1 mt -138.95 146.76 41.39 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.222 -0.445 . . . . 72.230000000000004 110.937 179.893 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 41.8 p -112.62 175.12 5.57 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.185 -0.461 . . . . 72.209999999999994 111.131 179.934 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -57.1 -45.05 83.71 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.175 -0.466 . . . . 73.230000000000004 110.877 179.882 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 13.6 tp10 -62.55 -33.64 75.33 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.174 -0.466 . . . . 73.430000000000007 110.871 -179.898 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 18.5 tt0 -73.84 -31.4 63.18 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.184 -0.462 . . . . 75.209999999999994 110.91 -179.942 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 65.0 t -72.5 -30.72 35.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.135 -0.484 . . . . 72.349999999999994 111.083 -179.986 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -51.94 -47.24 64.8 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.193 -0.458 . . . . 74.430000000000007 110.86 179.928 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 13.0 tp10 -56.79 -29.51 62.75 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.201 -0.454 . . . . 73.109999999999999 110.917 -179.917 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 17.2 mtp -73.96 -59.01 2.92 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.129 -0.487 . . . . 72.400000000000006 110.898 179.973 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 35.4 mm -53.93 -35.76 28.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.211 -0.45 . . . . 74.519999999999996 111.161 179.926 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 63.8 ttt180 -65.13 -31.83 73.22 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.15 -0.477 . . . . 74.5 110.888 179.944 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -72.46 -50.2 27.82 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.158 -0.474 . . . . 73.340000000000003 110.871 -179.931 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -69.36 -34.01 73.94 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.204 -0.453 . . . . 74.319999999999993 111.064 179.961 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 50.3 t0 -68.41 86.6 0.29 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.229 -0.442 . . . . 75.030000000000001 110.818 -179.984 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 60.0 mt -79.93 -45.56 22.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.221 -0.445 . . . . 74.510000000000005 111.091 179.969 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 22.6 p30 -72.73 -8.79 57.12 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.192 -0.458 . . . . 73.329999999999998 110.827 179.928 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 62.77 43.34 99.1 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.717 -0.754 . . . . 50.329999999999998 112.512 -179.932 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 32.5 p-10 -88.69 -16.02 33.38 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.902 0.382 . . . . 53.420000000000002 110.888 -179.944 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 103.37 2.94 47.67 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.691 -0.766 . . . . 73.439999999999998 112.482 -179.936 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 5.1 tt0 -149.25 172.26 15.15 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.799 0.333 . . . . 73.019999999999996 110.898 -179.861 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 136' ' ' VAL . . . . . . . . . . . . . 96.1 t -109.89 118.69 57.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.181 -0.463 . . . . 74.519999999999996 111.143 179.963 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 44.2 p-10 -102.16 166.85 10.37 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.204 -0.453 . . . . 74.349999999999994 110.928 179.989 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 48.0 t80 -51.9 -45.62 64.26 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.206 -0.452 . . . . 72.340000000000003 110.913 -179.893 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 6.1 tm-20 -53.4 -40.61 65.19 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.122 -0.49 . . . . 74.400000000000006 110.833 -179.941 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 17.5 mt-10 -78.43 -34.5 47.82 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.154 -0.476 . . . . 74.019999999999996 110.906 -179.91 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 41.1 t80 -67.15 -35.41 79.64 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.184 -0.462 . . . . 72.319999999999993 110.856 -179.925 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 97.8 t -64.67 -44.04 96.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.179 -0.464 . . . . 71.319999999999993 111.105 -179.998 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 48.6 tt0 -74.23 -23.84 59.23 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.214 -0.448 . . . . 73.230000000000004 110.88 -179.954 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 8.7 tpt -74.99 -18.85 60.3 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.169 -0.469 . . . . 71.120000000000005 110.911 179.97 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 9.2 ttm -98.23 -30.75 12.44 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.22 -0.445 . . . . 75.439999999999998 110.884 179.971 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 4.7 t -76.76 -23.56 52.97 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.236 -0.438 . . . . 75.430000000000007 111.174 -179.993 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -87.89 -75.51 0.41 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.194 -0.457 . . . . 74.129999999999995 111.081 179.846 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 17.0 mttm . . . . . 0 C--N 1.328 -0.336 0 CA-C-N 116.215 -0.448 . . . . 72.150000000000006 110.895 179.984 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' M' M ' 8' ' ' LEU . . . . . . . . . . . . . 4.2 pp . . . . . 0 C--O 1.231 0.11 0 CA-C-O 120.815 0.341 . . . . 65.120000000000005 110.961 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' M' M ' 9' ' ' SER . . . . . . . . . . . . . 55.2 m -148.13 179.12 7.98 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.203 -0.453 . . . . 72.219999999999999 110.867 -179.914 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' M' M ' 10' ' ' GLY . . . . . . . . . . . . . . . -142.24 -177.63 17.5 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.775 -0.726 . . . . 74.409999999999997 112.493 -179.972 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' M' M ' 11' ' ' GLY . . . . . . . . . . . . . . . 57.23 24.73 52.49 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.792 -0.718 . . . . 62.409999999999997 112.461 -179.937 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' M' M ' 12' ' ' GLU . . . . . . . . . . . . . 1.7 pt-20 -130.48 95.9 4.0 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.874 0.369 . . . . 75.409999999999997 110.887 -179.888 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' M' M ' 13' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -87.7 76.08 8.89 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.142 -0.481 . . . . 74.319999999999993 110.972 179.98 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' M' M ' 14' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -102.02 23.61 11.27 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.209 -0.45 . . . . 73.129999999999995 110.889 179.862 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' M' M ' 15' ' ' LYS . . . . . . . . . . . . . 40.5 mttp -79.09 -45.18 20.58 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.159 -0.473 . . . . 72.120000000000005 110.875 179.987 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' M' M ' 16' ' ' TRP . . . . . . . . . . . . . 24.2 m95 -53.77 -34.5 59.21 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.278 -0.419 . . . . 73.209999999999994 110.926 179.964 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' M' M ' 17' ' ' GLU . . . . . . . . . . . . . 5.3 tm-20 -58.67 -25.91 63.27 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.229 -0.441 . . . . 73.010000000000005 110.884 179.997 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' M' M ' 18' ' ' LYS . . . . . . . . . . . . . 16.0 ttpp -67.66 -26.85 66.41 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.185 -0.461 . . . . 74.519999999999996 110.91 179.951 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' M' M ' 19' ' ' ILE . . . . . . . . . . . . . 28.2 mt -92.61 -22.81 5.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.215 -0.448 . . . . 73.099999999999994 111.13 179.879 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' M' M ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.63 -45.55 61.7 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.165 -0.471 . . . . 73.129999999999995 110.856 179.983 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' M' M ' 21' ' ' LEU . . . . . . . . . . . . . 8.1 mt 63.08 -174.81 0.15 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.192 -0.458 . . . . 74.409999999999997 110.923 -179.978 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' M' M ' 22' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -121.86 144.88 42.02 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.622 0.725 . . . . 73.329999999999998 110.848 179.938 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' M' M ' 23' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.75 -47.74 0.87 Allowed 'Trans proline' 0 C--N 1.341 0.163 0 C-N-CA 122.676 2.251 . . . . 73.310000000000002 112.346 179.988 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' M' M ' 24' ' ' GLY . . . . . . . . . . . . . . . 109.35 120.45 4.31 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.747 -0.74 . . . . 74.299999999999997 112.461 179.964 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' M' M ' 25' ' ' GLY . . . . . . . . . . . . . . . 69.4 117.75 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.697 -0.763 . . . . 51.420000000000002 112.527 -179.906 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' M' M ' 26' ' ' LYS . . . . . . . . . . . . . 29.9 mmtp -111.09 113.39 25.89 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.789 0.328 . . . . 63.43 110.908 -179.963 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' M' M ' 27' ' ' LYS . . . . . . . . . . . . . 21.7 tptp -164.09 128.98 2.8 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.249 -0.432 . . . . 74.310000000000002 110.894 179.832 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' M' M ' 28' ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 -138.1 -74.51 0.4 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.242 -0.435 . . . . 75.349999999999994 110.902 179.965 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' M' M ' 29' ' ' TYR . . . . . . . . . . . . . 2.2 m-85 -65.22 -79.73 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.234 -0.439 . . . . 72.120000000000005 110.955 -179.886 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' M' M ' 30' ' ' LYS . . . . . . . . . . . . . 2.1 mtpp 176.17 -42.99 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.121 -0.491 . . . . 71.349999999999994 110.887 179.9 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' M' M ' 31' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -82.89 -21.16 34.34 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.209 -0.45 . . . . 75.519999999999996 110.902 179.93 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' M' M ' 32' ' ' LYS . . . . . . . . . . . . . 25.1 ttpp -48.04 -48.61 32.99 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.198 -0.455 . . . . 73.209999999999994 110.93 179.813 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' M' M ' 33' ' ' HIS . . . . . . . . . . . . . 11.1 t-80 -52.01 -37.5 53.5 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.233 -0.439 . . . . 75.510000000000005 110.846 179.87 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' M' M ' 34' ' ' ILE . . . . . . . . . . . . . 36.3 mm -51.66 -37.19 19.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.184 -0.462 . . . . 73.400000000000006 111.108 -179.991 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' M' M ' 35' ' ' VAL . . . . . . . . . . . . . 46.3 t -49.48 -38.45 12.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.207 -0.451 . . . . 74.299999999999997 111.126 179.862 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' M' M ' 36' ' ' TRP . . . . . . . . . . . . . 16.9 m0 -58.6 -39.52 80.63 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.19 -0.459 . . . . 74.099999999999994 110.919 179.999 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' M' M ' 37' ' ' ALA . . . . . . . . . . . . . . . -63.44 -18.7 64.02 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.193 -0.458 . . . . 60.130000000000003 111.096 179.905 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' M' M ' 38' ' ' SER . . . . . . . . . . . . . 1.1 m -70.62 -18.03 62.87 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.18 -0.464 . . . . 72.219999999999999 110.908 -179.798 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' M' M ' 39' ' ' ARG . . . . . . . . . . . . . 8.7 mmm180 -61.48 -25.14 67.05 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.118 -0.492 . . . . 75.040000000000006 110.92 -179.963 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' M' M ' 40' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -85.51 -47.97 9.4 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.143 -0.48 . . . . 74.230000000000004 110.851 -179.904 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' M' M ' 41' ' ' LEU . . . . . . . . . . . . . 12.0 mt -60.77 157.31 15.15 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.191 -0.458 . . . . 74.030000000000001 110.882 -179.933 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' M' M ' 42' ' ' GLU . . . . . . . . . . . . . 17.5 mt-10 -141.09 26.83 2.0 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.169 -0.469 . . . . 75.230000000000004 110.865 179.945 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' M' M ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.326 0 CA-C-N 116.17 -0.468 . . . . 74.430000000000007 110.854 -179.903 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 241' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 262' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 301' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 322' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 35.4 tp60 . . . . . 0 C--O 1.232 0.133 0 CA-C-O 120.788 0.328 . . . . 74.3 110.898 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 69.3 mt -71.72 -37.44 62.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.209 -0.45 . . . . 74.21 111.133 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -52.18 -32.92 38.4 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.158 -0.474 . . . . 32.53 111.087 179.796 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 -74.82 -52.1 12.28 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.231 -0.441 . . . . 73.51 110.893 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.556 ' CB ' HD13 ' A' ' 69' ' ' LEU . 50.1 m-85 -58.34 -46.0 87.07 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.181 -0.463 . . . . 65.3 110.843 -179.901 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.0 ttpt -54.89 -29.57 56.11 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.124 -0.489 . . . . 74.5 110.929 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -71.18 -30.76 66.82 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.198 -0.456 . . . . 52.22 110.932 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -64.96 -42.61 94.45 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.157 -0.474 . . . . 64.34 111.107 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 48.5 t80 -55.41 -54.21 46.62 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.168 -0.469 . . . . 71.55 110.898 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 36.5 t -51.99 -36.64 50.4 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.112 -0.495 . . . . 64.34 110.871 -179.812 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 17.7 tp -59.73 -41.62 91.32 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.15 -0.477 . . . . 71.41 110.897 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.412 ' CD1' HG11 ' A' ' 35' ' ' VAL . 33.9 m-85 -82.59 -25.87 32.85 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.227 -0.442 . . . . 74.31 110.852 179.982 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 11.1 t0 -86.69 98.53 11.18 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.179 -0.464 . . . . 53.12 110.89 179.962 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 70.4 mmtt -72.57 -56.85 4.71 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.166 -0.47 . . . . 73.55 110.894 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 27.1 p-10 -72.84 -10.09 59.4 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.206 -0.452 . . . . 63.14 110.835 179.922 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 52.05 49.08 50.74 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.759 -0.734 . . . . 73.5 112.465 -179.935 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 31.1 p-10 -88.53 -15.62 34.76 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.855 0.359 . . . . 55.33 110.871 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 105.31 -11.68 47.69 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.748 -0.739 . . . . 73.4 112.521 -179.912 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 49.0 p -135.21 130.69 35.66 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.75 0.31 . . . . 64.53 111.146 -179.879 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 24.7 mt -88.14 126.44 41.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.206 -0.452 . . . . 62.0 111.109 179.908 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.681 HG22 ' CG2' ' A' ' 62' ' ' THR . 60.4 p -110.33 176.2 5.14 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.187 -0.46 . . . . 50.32 111.143 179.962 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 21.7 p -64.12 -32.88 74.61 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.242 -0.435 . . . . 71.23 111.128 -179.964 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 43.5 mtpt -69.72 -43.53 72.16 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.204 -0.453 . . . . 65.23 110.932 179.901 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -75.21 -33.74 61.42 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.224 -0.444 . . . . 75.12 110.903 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.1 tt -74.28 -54.9 6.73 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.132 -0.485 . . . . 74.41 110.918 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -52.17 -28.53 26.56 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.739 -0.743 . . . . 73.4 112.467 179.91 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 94.9 m -70.84 -54.83 10.12 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.865 0.364 . . . . 72.44 111.17 -179.864 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.412 HG11 ' CD1' ' A' ' 19' ' ' PHE . 97.6 t -56.39 -46.67 82.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.171 -0.468 . . . . 75.21 111.122 179.9 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 31.3 mtp -55.96 -31.57 63.09 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.171 -0.468 . . . . 63.1 110.838 179.946 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 12.6 tpt180 -59.83 -53.32 59.28 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.265 -0.425 . . . . 73.0 110.863 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' SER . . . . . 0.578 ' OG ' HD21 ' M' ' 41' ' ' LEU . 2.2 t -61.87 -26.6 68.24 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.185 -0.462 . . . . 71.32 110.869 -179.775 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 1.01 HD13 ' HB3' ' M' ' 37' ' ' ALA . 53.8 mt -77.96 -24.62 48.08 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.126 -0.488 . . . . 53.13 110.948 179.962 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 100.84 33.08 5.13 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.755 -0.736 . . . . 40.52 112.451 179.88 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 5.0 tp-100 -130.86 105.82 8.02 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.805 0.336 . . . . 72.34 110.877 -179.902 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 59.1 t30 -109.92 76.75 1.0 Allowed Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.643 0.735 . . . . 54.44 110.923 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.75 167.97 22.9 Favored 'Trans proline' 0 C--O 1.232 0.186 0 C-N-CA 122.685 2.256 . . . . 74.21 112.359 179.933 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 69.7 p -81.62 159.95 23.9 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.199 -0.455 . . . . 63.24 111.179 -179.986 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -52.06 -40.45 61.17 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.253 -0.431 . . . . 71.14 110.858 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.17 -31.48 64.25 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.194 -0.457 . . . . 75.32 111.081 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 27.1 tt0 -69.73 -45.94 67.01 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.223 -0.444 . . . . 73.04 110.891 -179.936 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 29.2 mt -55.33 -51.61 66.18 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.152 -0.476 . . . . 60.35 110.919 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -59.7 -28.98 67.78 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.183 -0.462 . . . . 73.33 110.885 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -70.28 -49.57 48.41 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.224 -0.443 . . . . 75.3 110.871 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' MET . . . . . 0.435 ' HE2' ' HG3' ' M' ' 30' ' ' LYS . 7.5 mtp -55.46 -52.65 62.92 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.204 -0.453 . . . . 75.31 110.863 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 62.8 mt -64.4 -37.72 80.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.257 -0.429 . . . . 63.41 111.128 179.941 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 19.4 m-20 -57.28 -41.74 80.35 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.195 -0.457 . . . . 73.32 110.912 179.907 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 16.3 mm-40 -53.13 -52.75 57.69 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.167 -0.469 . . . . 74.11 110.92 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 16.5 m -76.02 -19.26 15.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.155 -0.475 . . . . 75.05 111.126 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 38.8 t0 -66.86 95.98 0.39 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.165 -0.47 . . . . 45.42 110.856 179.931 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.21 -42.0 12.59 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.125 -0.488 . . . . 74.34 111.091 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -82.2 -0.15 43.76 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.245 -0.434 . . . . 62.54 110.864 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 53.62 60.86 7.67 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.763 -0.732 . . . . 71.33 112.489 -179.933 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 52.3 p-10 -114.49 -15.81 12.0 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.876 0.37 . . . . 73.15 110.889 -179.893 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 89.59 19.65 47.69 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.773 -0.727 . . . . 63.42 112.513 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' THR . . . . . 0.681 ' CG2' HG22 ' A' ' 28' ' ' THR . 33.4 p -152.07 156.78 40.59 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.763 0.316 . . . . 62.44 111.148 -179.829 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.498 ' CD1' HD21 ' M' ' 31' ' ' LEU . 18.4 mt -93.37 111.04 24.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.209 -0.451 . . . . 74.43 111.123 179.921 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -75.72 -172.91 2.03 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.154 -0.475 . . . . 73.23 110.842 179.862 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.53 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 2.4 t80 -65.43 -58.28 12.42 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.633 0.73 . . . . 60.23 110.849 -179.855 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 66' ' ' PRO . . . . . 0.53 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 54.0 Cg_endo -69.7 -26.84 27.46 Favored 'Trans proline' 0 C--N 1.342 0.201 0 C-N-CA 122.64 2.227 . . . . 62.32 112.385 179.987 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 22.9 mt-10 -62.59 -39.99 95.49 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.21 -0.45 . . . . 72.44 110.872 -179.976 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 13.2 t80 -74.71 -35.71 62.7 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.14 -0.482 . . . . 72.42 110.882 -179.896 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.556 HD13 ' CB ' ' A' ' 12' ' ' PHE . 39.8 tp -70.56 -54.2 13.03 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.16 -0.473 . . . . 61.15 110.896 180.0 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 14.2 t -51.63 -30.4 21.31 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.165 -0.47 . . . . 71.54 111.176 179.938 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 37.3 ttp -59.71 -49.94 75.79 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.194 -0.457 . . . . 60.21 110.899 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' MET . . . . . 0.496 ' HE2' HG21 ' M' ' 35' ' ' VAL . 3.1 mmt -70.83 -25.81 63.01 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.184 -0.462 . . . . 71.42 110.872 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.278 0 CA-C-N 116.212 -0.449 . . . . 55.14 111.132 179.902 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.597 HD13 HG13 ' A' ' 142' ' ' VAL . 65.3 mt . . . . . 0 C--O 1.232 0.147 0 CA-C-O 120.828 0.346 . . . . 64.43 111.142 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 34.2 ttt-85 -71.24 -45.41 63.33 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.195 -0.457 . . . . 71.3 110.841 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.729 ' O ' HG23 ' A' ' 91' ' ' VAL . 10.2 tp10 -60.65 -53.77 53.38 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.222 -0.445 . . . . 74.42 110.893 -179.906 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -53.45 -47.85 69.34 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.183 -0.462 . . . . 22.12 111.088 179.896 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 3.0 t80 -52.09 -46.87 65.41 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.22 -0.446 . . . . 73.11 110.865 -179.899 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 22.5 ttm-85 -69.07 -31.71 70.66 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.154 -0.475 . . . . 71.44 110.863 -179.919 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 91' ' ' VAL . . . . . 0.729 HG23 ' O ' ' A' ' 87' ' ' GLU . 92.5 t -68.92 -27.34 35.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.163 -0.471 . . . . 74.52 111.121 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 17.9 m-85 -96.35 -26.59 15.31 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.183 -0.462 . . . . 73.13 110.899 179.975 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 29.6 t0 -69.48 94.57 0.76 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.141 -0.481 . . . . 71.53 110.913 179.922 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 9.7 ttmm -78.47 -52.82 7.97 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.223 -0.444 . . . . 74.25 110.895 -179.994 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 50.3 p30 -72.52 -9.14 58.2 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.176 -0.466 . . . . 71.13 110.789 179.938 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 60.17 27.64 65.43 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.77 -0.729 . . . . 75.22 112.464 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 39.6 p-10 -82.85 -16.22 48.5 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.879 0.371 . . . . 72.33 110.901 -179.942 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 86.47 18.67 58.35 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.748 -0.739 . . . . 70.35 112.473 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 12.4 m-85 -140.47 145.37 36.85 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.852 0.358 . . . . 72.42 110.929 -179.819 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 66.7 mt -111.5 127.02 68.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.119 -0.492 . . . . 75.31 111.13 179.93 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 26.4 p -117.0 174.67 5.97 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.155 -0.475 . . . . 62.21 110.853 -179.893 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -60.03 -30.02 68.9 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.15 -0.477 . . . . 61.54 111.113 179.912 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -69.93 -46.12 66.03 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.215 -0.448 . . . . 63.43 111.089 179.931 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 55.5 mt-10 -72.5 -46.61 53.89 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.218 -0.446 . . . . 74.42 110.881 -179.893 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.596 HD21 ' HE2' ' A' ' 124' ' ' MET . 44.1 tp -55.84 -46.54 78.15 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.187 -0.461 . . . . 74.12 110.951 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 106' ' ' ARG . . . . . 0.671 ' HB2' HG21 ' A' ' 121' ' ' VAL . 56.8 ttp85 -58.31 -33.76 69.84 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.168 -0.469 . . . . 71.44 110.9 179.886 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 79.6 t60 -72.18 -36.4 69.25 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.176 -0.465 . . . . 73.5 110.836 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 83.8 t -66.78 -40.82 86.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.2 -0.454 . . . . 74.2 111.124 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 109' ' ' MET . . . . . 0.651 ' HE2' HD11 ' M' ' 19' ' ' ILE . 11.2 mmt -64.15 -27.9 69.39 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.183 -0.462 . . . . 73.43 110.883 179.91 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 1.5 m -66.08 -42.0 89.95 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.244 -0.435 . . . . 75.1 111.145 -179.923 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 33.4 t30 -58.63 -34.3 71.02 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.283 -0.417 . . . . 70.44 110.922 179.975 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 18.0 mt -73.25 -26.22 61.02 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.158 -0.474 . . . . 72.44 110.918 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 100.48 31.1 5.94 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.723 -0.751 . . . . 54.24 112.508 179.929 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -108.73 114.68 28.67 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.903 0.382 . . . . 74.31 110.88 -179.855 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.4 102.03 2.09 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.116 -0.493 . . . . 73.34 110.899 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.477 HD12 ' CB ' ' A' ' 109' ' ' MET . 11.1 mt -133.21 146.81 51.82 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.215 -0.448 . . . . 62.32 110.894 179.948 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 117' ' ' THR . . . . . 0.541 ' O ' HG23 ' A' ' 121' ' ' VAL . 29.2 p -108.51 -175.39 2.76 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.141 -0.481 . . . . 63.04 111.115 179.949 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 72.6 m-20 -65.57 -38.91 90.92 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.169 -0.468 . . . . 73.24 110.878 179.916 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -65.43 -33.47 76.03 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.176 -0.465 . . . . 73.11 110.93 -179.929 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 19.0 tt0 -72.11 -49.8 33.28 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.12 -0.491 . . . . 72.53 110.905 -179.909 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.671 HG21 ' HB2' ' A' ' 106' ' ' ARG . 58.3 t -54.45 -31.16 22.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.175 -0.466 . . . . 71.22 111.131 179.937 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -51.94 -42.7 63.04 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.193 -0.458 . . . . 52.22 110.879 179.948 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 11.4 tp10 -62.94 -31.4 72.48 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.164 -0.471 . . . . 74.43 110.905 -179.909 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 124' ' ' MET . . . . . 0.596 ' HE2' HD21 ' A' ' 105' ' ' LEU . 94.8 mtp -72.99 -59.47 2.69 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.098 -0.501 . . . . 74.31 110.869 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 35.9 mm -53.99 -35.59 28.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.208 -0.451 . . . . 73.44 111.146 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 39.1 ttt85 -63.33 -31.9 73.18 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.199 -0.455 . . . . 73.14 110.898 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 19.3 tp10 -74.85 -52.37 11.52 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.137 -0.483 . . . . 74.41 110.871 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.653 ' HB3' HG22 ' A' ' 136' ' ' VAL . . . -65.11 -34.43 78.38 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.185 -0.461 . . . . 35.24 111.102 179.967 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 49.4 t0 -68.4 86.77 0.29 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.167 -0.47 . . . . 75.1 110.862 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 58.0 mt -79.83 -46.23 22.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.184 -0.462 . . . . 73.22 111.085 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 21.2 p30 -72.76 -8.67 56.58 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.176 -0.465 . . . . 62.45 110.84 179.89 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 62.71 42.99 99.61 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.745 -0.741 . . . . 54.14 112.5 -179.914 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 34.8 p-10 -88.08 -15.95 34.86 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.881 0.372 . . . . 75.14 110.89 -179.976 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 104.1 2.36 45.16 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.733 -0.746 . . . . 60.05 112.496 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 5.6 tt0 -149.19 172.24 15.15 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.858 0.361 . . . . 73.44 110.906 -179.85 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 136' ' ' VAL . . . . . 0.653 HG22 ' HB3' ' A' ' 128' ' ' ALA . 94.6 t -107.51 111.31 35.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.233 -0.44 . . . . 72.22 111.125 179.935 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 44.0 p-10 -92.5 166.13 12.68 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.136 -0.484 . . . . 44.22 110.934 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 138' ' ' TYR . . . . . 0.609 ' O ' HG23 ' A' ' 142' ' ' VAL . 78.1 t80 -51.96 -46.72 64.89 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.203 -0.453 . . . . 75.13 110.961 -179.93 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -51.98 -41.04 61.84 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.092 -0.504 . . . . 75.35 110.913 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -78.44 -36.26 45.7 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.14 -0.482 . . . . 75.14 110.873 -179.92 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 66.0 t80 -64.67 -35.51 81.27 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.136 -0.484 . . . . 51.24 110.87 -179.938 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 142' ' ' VAL . . . . . 0.609 HG23 ' O ' ' A' ' 138' ' ' TYR . 94.4 t -69.77 -38.5 76.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.169 -0.468 . . . . 64.14 111.094 -179.982 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 45.0 tt0 -71.37 -36.56 71.49 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.19 -0.459 . . . . 73.2 110.926 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 5.7 tpt -72.81 -29.16 63.03 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.194 -0.457 . . . . 73.31 110.881 179.969 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -84.32 -27.91 27.45 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.24 -0.436 . . . . 74.05 110.846 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 87.6 m . . . . . 0 C--N 1.329 -0.284 0 CA-C-N 116.231 -0.44 . . . . 63.22 111.108 -179.898 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' M' M ' 15' ' ' LYS . . . . . . . . . . . . . 20.0 mttm . . . . . 0 C--O 1.231 0.126 0 CA-C-O 120.735 0.302 . . . . 74.43 110.871 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' M' M ' 16' ' ' TRP . . . . . 0.623 ' CE3' HD12 ' M' ' 19' ' ' ILE . 7.2 m95 -52.1 -45.9 65.05 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.257 -0.429 . . . . 75.45 110.931 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' M' M ' 17' ' ' GLU . . . . . . . . . . . . . 15.8 tm-20 -57.52 -27.2 62.38 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.211 -0.449 . . . . 71.25 110.897 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' M' M ' 18' ' ' LYS . . . . . . . . . . . . . 8.9 ttmm -69.93 -27.6 64.9 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.158 -0.473 . . . . 74.51 110.859 179.989 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' M' M ' 19' ' ' ILE . . . . . 0.651 HD11 ' HE2' ' A' ' 109' ' ' MET . 34.3 mt -83.09 -25.22 8.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.245 -0.434 . . . . 64.21 111.146 179.863 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' M' M ' 20' ' ' ARG . . . . . . . . . . . . . 22.7 ttp180 . . . . . 0 C--N 1.329 -0.311 0 CA-C-N 116.171 -0.468 . . . . 75.33 110.853 179.967 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' M' M ' 30' ' ' LYS . . . . . 0.435 ' HG3' ' HE2' ' A' ' 51' ' ' MET . 17.8 tptt . . . . . 0 C--O 1.232 0.147 0 CA-C-O 120.871 0.367 . . . . 72.33 110.946 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' M' M ' 31' ' ' LEU . . . . . 0.498 HD21 ' CD1' ' A' ' 63' ' ' ILE . 18.9 tp -179.76 -39.07 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.212 -0.449 . . . . 73.31 110.896 179.912 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' M' M ' 32' ' ' LYS . . . . . . . . . . . . . 1.6 tmtt? -50.26 -40.95 49.52 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.23 -0.441 . . . . 74.41 110.907 179.849 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' M' M ' 33' ' ' HIS . . . . . . . . . . . . . 83.9 t60 -50.25 -38.68 41.99 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.23 -0.441 . . . . 51.51 110.894 179.842 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' M' M ' 34' ' ' ILE . . . . . . . . . . . . . 48.8 mm -50.13 -39.77 16.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.2 -0.455 . . . . 71.11 111.102 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' M' M ' 35' ' ' VAL . . . . . 0.496 HG21 ' HE2' ' A' ' 72' ' ' MET . 97.0 t -49.16 -40.18 13.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.228 -0.442 . . . . 74.12 111.1 179.869 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' M' M ' 36' ' ' TRP . . . . . . . . . . . . . 24.7 m0 -58.57 -39.67 80.98 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.196 -0.456 . . . . 73.3 110.906 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' M' M ' 37' ' ' ALA . . . . . 1.01 ' HB3' HD13 ' A' ' 39' ' ' LEU . . . -63.99 -18.69 64.54 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.25 -0.432 . . . . 72.32 111.095 179.864 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' M' M ' 38' ' ' SER . . . . . . . . . . . . . 1.6 m -71.94 -17.93 62.05 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.278 -0.419 . . . . 64.01 110.876 -179.808 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' M' M ' 39' ' ' ARG . . . . . . . . . . . . . 3.5 tpt180 -57.56 -25.43 59.96 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.122 -0.49 . . . . 62.42 110.885 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' M' M ' 40' ' ' GLU . . . . . . . . . . . . . 12.4 mt-10 -85.94 -48.12 9.0 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.182 -0.463 . . . . 75.33 110.897 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' M' M ' 41' ' ' LEU . . . . . 0.578 HD21 ' OG ' ' A' ' 38' ' ' SER . 9.8 mt . . . . . 0 C--N 1.328 -0.33 0 CA-C-N 116.153 -0.476 . . . . 73.22 110.919 -179.941 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 16.5 tp60 . . . . . 0 C--O 1.232 0.149 0 CA-C-O 120.761 0.315 . . . . 74.13 110.873 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 72.0 mt -65.45 -47.25 87.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.201 -0.454 . . . . 75.51 111.112 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -56.23 -26.48 51.47 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.162 -0.472 . . . . 53.2 111.097 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -71.43 -44.31 65.11 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.227 -0.442 . . . . 62.13 110.882 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 26.1 m-85 -75.78 -45.9 33.69 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.207 -0.451 . . . . 73.44 110.876 -179.941 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 25.6 ttmt -55.47 -26.09 40.46 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.176 -0.466 . . . . 62.52 110.871 179.998 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 16.4 mm-40 -71.91 -40.25 68.97 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.24 -0.436 . . . . 71.34 110.889 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -60.1 -39.21 85.36 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.14 -0.482 . . . . 72.14 111.123 179.907 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 54.7 t80 -53.04 -52.02 59.86 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.193 -0.458 . . . . 75.44 110.909 -179.945 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 6.1 t -54.59 -30.37 54.32 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.171 -0.468 . . . . 74.15 110.852 -179.797 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.571 HD23 ' HB3' ' M' ' 38' ' ' SER . 15.5 tp -66.36 -45.04 81.49 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.089 -0.505 . . . . 74.22 110.929 179.991 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 57.3 m-85 -75.2 -26.21 58.81 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.235 -0.439 . . . . 72.2 110.896 179.898 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 12.9 t0 -78.27 98.56 5.95 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.108 -0.496 . . . . 61.34 110.884 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 1.3 tppp? -68.23 -51.97 39.33 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.178 -0.465 . . . . 54.34 110.894 -179.989 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 23.5 p-10 -79.51 -10.07 59.73 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.225 -0.443 . . . . 63.43 110.815 179.933 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 52.11 42.35 54.83 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.771 -0.728 . . . . 50.02 112.468 -179.938 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 19.6 p-10 -88.73 -15.69 34.12 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.896 0.379 . . . . 54.41 110.871 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 104.64 16.72 16.74 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.758 -0.734 . . . . 32.24 112.524 -179.955 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -154.64 130.71 10.25 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.76 0.314 . . . . 75.53 111.13 -179.834 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 29.3 mt -89.18 123.77 41.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.252 -0.431 . . . . 62.34 111.108 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.521 ' HA ' HG22 ' A' ' 62' ' ' THR . 43.5 p -98.58 -177.36 3.65 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.148 -0.478 . . . . 75.24 111.151 179.954 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.85 HG22 HD12 ' A' ' 52' ' ' ILE . 49.4 p -71.5 -39.56 70.75 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.235 -0.439 . . . . 74.14 111.171 -179.998 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 45.2 mmtt -68.9 -50.09 52.57 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.192 -0.458 . . . . 75.45 110.881 179.906 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.607 ' O ' HG23 ' A' ' 35' ' ' VAL . 32.8 mt-10 -59.19 -38.91 80.99 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.219 -0.446 . . . . 64.0 110.896 179.98 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.2 tt -74.3 -56.2 5.15 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.16 -0.473 . . . . 75.01 110.921 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -52.26 -44.42 57.83 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.748 -0.739 . . . . 74.14 112.46 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 92.4 m -56.49 -47.25 79.65 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.831 0.348 . . . . 65.02 111.165 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.607 HG23 ' O ' ' A' ' 31' ' ' GLU . 97.0 t -62.78 -51.11 76.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.197 -0.456 . . . . 73.04 111.13 179.937 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 21.4 mtp -51.91 -33.87 38.93 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.185 -0.461 . . . . 70.34 110.891 179.87 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 59.0 ttt85 -57.07 -54.59 45.01 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.271 -0.422 . . . . 70.22 110.906 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' SER . . . . . 0.653 ' OG ' HD21 ' M' ' 41' ' ' LEU . 1.7 t -60.98 -26.22 67.41 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.196 -0.456 . . . . 41.13 110.879 -179.836 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.992 HD13 ' HB3' ' M' ' 37' ' ' ALA . 69.7 mt -79.73 -18.91 50.04 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.137 -0.483 . . . . 62.33 110.904 179.972 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 101.55 28.85 6.51 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.753 -0.737 . . . . 71.4 112.519 179.931 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 2.9 tt0 -128.69 106.5 8.98 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.776 0.322 . . . . 72.41 110.901 -179.84 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 6.0 t-20 -109.86 76.9 1.0 Allowed Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.625 0.726 . . . . 71.24 110.868 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.72 158.99 55.11 Favored 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.711 2.274 . . . . 53.22 112.361 179.903 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 66.4 p -76.61 160.19 29.63 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.217 -0.447 . . . . 73.51 111.159 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 7.9 mt-10 -51.97 -39.52 59.45 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.172 -0.467 . . . . 73.14 110.933 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.26 -31.57 64.17 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.126 -0.488 . . . . 72.54 111.111 179.895 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 59.8 tt0 -69.71 -47.94 61.33 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.187 -0.461 . . . . 72.55 110.919 -179.941 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 29.3 mt -55.34 -51.84 65.47 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.126 -0.488 . . . . 74.34 110.892 -179.961 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 41.4 tp60 -60.05 -28.99 68.23 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.255 -0.43 . . . . 51.05 110.955 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 39.3 t0 -67.13 -46.61 73.59 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.161 -0.472 . . . . 63.42 110.853 179.926 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' MET . . . . . 0.583 ' HB3' HD22 ' M' ' 31' ' ' LEU . 10.9 mtp -58.72 -58.03 10.37 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.215 -0.448 . . . . 71.51 110.872 179.99 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.85 HD12 HG22 ' A' ' 29' ' ' THR . 74.1 mt -56.53 -37.56 52.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.224 -0.444 . . . . 74.42 111.148 179.976 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 63.9 m-20 -69.74 -34.63 74.11 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.17 -0.468 . . . . 64.3 110.883 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 25.5 mt-10 -61.57 -30.92 70.97 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.168 -0.469 . . . . 71.25 110.912 179.973 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 6.5 m -109.17 17.99 6.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.144 -0.48 . . . . 70.51 111.121 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 32.3 t0 -90.11 97.25 11.08 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.176 -0.466 . . . . 72.45 110.865 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.13 -45.32 10.23 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.151 -0.477 . . . . 72.41 111.09 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 19.8 p-10 -81.85 -0.09 41.94 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.256 -0.429 . . . . 72.12 110.86 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 54.35 57.31 17.65 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.736 -0.745 . . . . 74.14 112.484 -179.943 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 48.3 p-10 -114.48 -15.71 12.01 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.877 0.37 . . . . 45.51 110.902 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 90.28 21.94 36.57 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.773 -0.727 . . . . 63.13 112.489 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' THR . . . . . 0.521 HG22 ' HA ' ' A' ' 28' ' ' THR . 76.0 p -150.94 165.07 34.82 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.731 0.301 . . . . 54.14 111.119 -179.86 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 28.0 mt -94.61 114.44 31.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.187 -0.461 . . . . 73.43 111.099 179.891 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -78.41 -172.91 3.07 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.168 -0.469 . . . . 72.31 110.871 179.838 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.532 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 2.5 t80 -63.97 -58.4 14.75 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-O 121.672 0.748 . . . . 63.14 110.895 -179.902 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 66' ' ' PRO . . . . . 0.532 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 53.8 Cg_endo -69.7 -32.08 19.54 Favored 'Trans proline' 0 C--N 1.341 0.136 0 C-N-CA 122.724 2.283 . . . . 63.34 112.387 179.985 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 74.1 mt-10 -57.25 -42.67 81.94 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.166 -0.47 . . . . 63.43 110.907 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 78.7 t80 -70.83 -36.45 72.92 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.13 -0.486 . . . . 71.4 110.9 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 15.4 tp -67.53 -53.7 26.26 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.136 -0.484 . . . . 74.53 110.973 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 14.9 t -57.24 -29.43 63.78 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.16 -0.473 . . . . 74.15 111.185 179.899 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 45.8 ttp -61.15 -42.32 98.35 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.176 -0.466 . . . . 71.33 110.898 179.901 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 8.8 mtt -79.78 -45.91 17.95 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.217 -0.447 . . . . 72.14 110.918 179.939 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.317 0 CA-C-N 116.215 -0.448 . . . . 74.11 111.086 179.886 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.62 ' CG2' HG22 ' A' ' 142' ' ' VAL . 57.8 mt . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.799 0.333 . . . . 73.33 111.091 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 46.3 ttp180 -71.65 -28.22 63.61 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.181 -0.463 . . . . 74.24 110.897 179.959 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.681 ' O ' HG23 ' A' ' 91' ' ' VAL . 4.1 tp10 -71.89 -29.14 64.03 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.164 -0.471 . . . . 71.52 110.888 -179.914 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 88' ' ' ALA . . . . . 0.467 ' HB1' ' CE2' ' A' ' 92' ' ' PHE . . . -76.35 -35.64 58.62 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.14 -0.482 . . . . 63.41 111.096 179.949 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 3.9 t80 -56.82 -49.31 75.79 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.196 -0.456 . . . . 74.03 110.863 -179.904 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 10.5 ptm180 -62.82 -26.16 68.6 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.102 -0.499 . . . . 71.33 110.888 -179.886 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 91' ' ' VAL . . . . . 0.681 HG23 ' O ' ' A' ' 87' ' ' GLU . 91.8 t -74.0 -45.74 47.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.201 -0.454 . . . . 75.21 111.156 179.951 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.467 ' CE2' ' HB1' ' A' ' 88' ' ' ALA . 9.5 m-85 -75.54 -34.76 60.78 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.126 -0.488 . . . . 74.14 110.864 -179.993 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 28.5 t0 -64.52 93.05 0.09 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.175 -0.466 . . . . 63.41 110.867 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 1.5 ttmp? -78.71 -52.75 7.96 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.175 -0.466 . . . . 65.21 110.883 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 54.1 p-10 -72.71 -9.08 58.21 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.201 -0.454 . . . . 43.2 110.854 179.911 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 60.97 33.53 84.21 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.759 -0.734 . . . . 54.2 112.517 -179.943 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 40.7 p-10 -85.52 -16.22 40.22 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.876 0.37 . . . . 72.1 110.896 -179.9 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 85.87 18.63 59.37 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.732 -0.747 . . . . 60.55 112.497 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 14.5 m-85 -140.75 151.01 44.11 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.833 0.349 . . . . 53.04 110.947 -179.799 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 64.0 mt -115.82 127.24 73.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.144 -0.48 . . . . 63.01 111.172 179.877 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 89.4 p -116.62 -171.47 2.02 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.186 -0.461 . . . . 61.12 110.836 -179.87 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -68.61 -44.77 73.58 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.133 -0.485 . . . . 70.3 111.085 179.947 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -63.8 -38.01 89.51 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.223 -0.444 . . . . 62.51 111.063 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 23.6 mt-10 -76.04 -52.07 10.96 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.216 -0.447 . . . . 74.2 110.858 -179.889 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.667 HD21 ' HG2' ' A' ' 124' ' ' MET . 35.2 tp -53.37 -52.42 59.31 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.192 -0.458 . . . . 70.0 110.952 179.998 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 50.8 ttt180 -52.27 -43.48 64.41 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.187 -0.46 . . . . 75.12 110.883 179.934 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 77.6 t60 -54.27 -34.43 60.81 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.147 -0.478 . . . . 74.23 110.893 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 92.8 t -70.25 -48.28 62.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.18 -0.463 . . . . 74.23 111.133 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 109' ' ' MET . . . . . 0.614 ' HG2' HD11 ' A' ' 116' ' ' LEU . 0.2 OUTLIER -64.4 -28.23 69.54 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.186 -0.461 . . . . 71.24 110.877 179.885 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 15.6 m -62.53 -30.95 71.66 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.238 -0.437 . . . . 70.22 111.145 -179.936 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -74.71 -25.34 59.06 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.258 -0.428 . . . . 72.43 110.899 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -70.63 -25.68 63.14 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.137 -0.483 . . . . 64.13 110.948 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 99.62 19.77 19.22 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.747 -0.739 . . . . 61.2 112.466 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -103.44 112.86 25.96 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.961 0.41 . . . . 72.41 110.862 -179.845 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 16.2 mtpp -65.07 124.59 22.51 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.167 -0.47 . . . . 74.14 110.86 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.614 HD11 ' HG2' ' A' ' 109' ' ' MET . 5.2 mt -138.65 160.51 39.46 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.234 -0.439 . . . . 75.32 110.883 179.909 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 34.5 p -118.87 167.61 11.55 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.161 -0.472 . . . . 63.44 111.113 179.976 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 51.8 m-20 -52.34 -35.83 51.9 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.24 -0.437 . . . . 75.2 110.882 179.915 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 84.4 tt0 -72.81 -35.34 67.31 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.18 -0.464 . . . . 64.4 110.916 -179.92 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 36.2 tp10 -64.8 -44.54 89.59 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.138 -0.483 . . . . 63.13 110.872 -179.919 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 58.3 t -57.44 -40.46 74.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.159 -0.473 . . . . 70.01 111.092 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -52.2 -49.82 63.13 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.235 -0.439 . . . . 64.22 110.83 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 15.7 tp10 -55.8 -29.43 59.71 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.21 -0.45 . . . . 74.43 110.93 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 124' ' ' MET . . . . . 0.667 ' HG2' HD21 ' A' ' 105' ' ' LEU . 2.9 ttt -72.65 -59.87 2.51 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.149 -0.478 . . . . 65.35 110.876 -179.973 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.49 HG23 HG23 ' A' ' 136' ' ' VAL . 33.7 mm -54.25 -35.72 30.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.229 -0.441 . . . . 75.44 111.129 179.943 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 40.8 ttt180 -63.41 -31.79 73.04 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.172 -0.467 . . . . 75.24 110.869 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 12.2 tm-20 -72.85 -50.65 22.67 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.169 -0.469 . . . . 74.33 110.932 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.562 ' HB3' ' CG2' ' A' ' 136' ' ' VAL . . . -69.68 -26.83 64.56 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.145 -0.48 . . . . 44.55 111.091 179.96 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 51.2 t0 -75.04 86.49 2.34 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.241 -0.436 . . . . 73.05 110.853 179.953 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 130' ' ' ILE . . . . . 0.775 HD12 ' HG2' ' A' ' 140' ' ' GLU . 4.9 mt -79.89 -45.19 22.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.215 -0.448 . . . . 72.02 111.139 179.972 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 18.2 p30 -72.42 -8.9 57.46 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.206 -0.452 . . . . 60.3 110.853 179.843 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 62.64 43.95 98.24 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.705 -0.759 . . . . 64.54 112.455 -179.927 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 33.7 p-10 -89.56 -15.96 31.71 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.858 0.361 . . . . 73.15 110.839 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 101.63 3.86 52.62 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.719 -0.753 . . . . 44.04 112.526 -179.931 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 4.7 tt0 -149.2 172.23 15.17 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.796 0.332 . . . . 73.12 110.918 -179.863 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 136' ' ' VAL . . . . . 0.562 ' CG2' ' HB3' ' A' ' 128' ' ' ALA . 95.9 t -114.08 111.49 36.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.197 -0.456 . . . . 65.15 111.131 179.934 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 14.7 p30 -91.46 170.96 9.53 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.215 -0.448 . . . . 74.15 110.909 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 45.5 t80 -55.01 -47.37 74.76 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.141 -0.481 . . . . 74.04 110.953 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -52.25 -50.62 61.7 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.112 -0.494 . . . . 72.04 110.879 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 140' ' ' GLU . . . . . 0.775 ' HG2' HD12 ' A' ' 130' ' ' ILE . 95.6 mt-10 -66.77 -31.72 72.55 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.152 -0.476 . . . . 64.23 110.885 -179.911 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 49.8 t80 -67.61 -50.18 59.4 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.147 -0.479 . . . . 74.2 110.861 -179.946 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 142' ' ' VAL . . . . . 0.62 HG22 ' CG2' ' A' ' 85' ' ' ILE . 73.0 t -62.79 -38.5 81.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.172 -0.467 . . . . 75.22 111.102 -179.973 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 143' ' ' GLN . . . . . 0.442 ' OE1' HD13 ' A' ' 130' ' ' ILE . 64.6 tt0 -57.46 -36.71 71.8 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.183 -0.462 . . . . 73.42 110.941 179.99 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 11.5 tpt -74.3 -55.47 5.98 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.182 -0.463 . . . . 74.33 110.896 179.938 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 21.0 ttm -59.42 -22.44 61.45 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.225 -0.443 . . . . 74.12 110.865 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 94.8 m . . . . . 0 C--N 1.33 -0.259 0 CA-C-N 116.249 -0.432 . . . . 71.15 111.167 -179.973 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' M' M ' 15' ' ' LYS . . . . . . . . . . . . . 4.3 mtmp? . . . . . 0 C--O 1.231 0.116 0 CA-C-O 120.757 0.313 . . . . 54.22 110.895 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' M' M ' 16' ' ' TRP . . . . . 0.48 ' CZ2' ' HB2' ' A' ' 128' ' ' ALA . 44.3 m95 -51.83 -30.12 22.14 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.233 -0.439 . . . . 61.44 110.92 179.891 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' M' M ' 17' ' ' GLU . . . . . . . . . . . . . 5.4 tm-20 -54.25 -39.32 66.72 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.983 0.42 . . . . 71.41 110.911 -179.984 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' M' M ' 18' ' ' LYS . . . . . . . . . . . . . 4.8 ttpm? -62.82 -23.44 67.27 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.12 -0.491 . . . . 72.05 110.887 179.93 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' M' M ' 19' ' ' ILE . . . . . . . . . . . . . 21.8 mm -70.89 -34.35 55.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.209 -0.45 . . . . 65.2 111.105 179.924 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' M' M ' 20' ' ' ARG . . . . . . . . . . . . . 25.4 ttm180 . . . . . 0 C--N 1.329 -0.326 0 CA-C-N 116.192 -0.458 . . . . 71.4 110.868 179.961 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' M' M ' 30' ' ' LYS . . . . . . . . . . . . . 8.1 pttm . . . . . 0 C--O 1.232 0.149 0 CA-C-O 120.815 0.34 . . . . 62.44 110.888 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' M' M ' 31' ' ' LEU . . . . . 0.583 HD22 ' HB3' ' A' ' 51' ' ' MET . 19.4 tp -121.92 -34.66 3.32 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.242 -0.435 . . . . 72.21 110.891 179.938 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' M' M ' 32' ' ' LYS . . . . . . . . . . . . . 4.8 pttm -51.31 -39.85 57.79 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.223 -0.444 . . . . 74.0 110.865 179.838 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' M' M ' 33' ' ' HIS . . . . . . . . . . . . . 10.4 t-160 -50.92 -36.74 40.02 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.245 -0.434 . . . . 74.24 110.848 179.91 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' M' M ' 34' ' ' ILE . . . . . . . . . . . . . 50.7 mm -50.16 -39.17 15.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.203 -0.453 . . . . 72.23 111.136 -179.961 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' M' M ' 35' ' ' VAL . . . . . . . . . . . . . 58.3 t -49.31 -39.76 13.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.161 -0.472 . . . . 74.41 111.144 179.836 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' M' M ' 36' ' ' TRP . . . . . . . . . . . . . 23.0 m0 -58.64 -39.36 80.32 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.141 -0.481 . . . . 64.24 110.931 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' M' M ' 37' ' ' ALA . . . . . 0.992 ' HB3' HD13 ' A' ' 39' ' ' LEU . . . -63.84 -18.65 64.36 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.23 -0.441 . . . . 74.24 111.05 179.935 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' M' M ' 38' ' ' SER . . . . . 0.571 ' HB3' HD23 ' A' ' 18' ' ' LEU . 0.7 OUTLIER -72.9 -18.06 61.45 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.229 -0.441 . . . . 75.44 110.853 -179.811 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' M' M ' 39' ' ' ARG . . . . . . . . . . . . . 20.0 ptt180 -57.69 -26.3 61.51 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.17 -0.468 . . . . 74.11 110.873 -179.899 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' M' M ' 40' ' ' GLU . . . . . . . . . . . . . 12.7 tp10 -85.86 -47.94 9.22 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.161 -0.472 . . . . 72.22 110.856 -179.914 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' M' M ' 41' ' ' LEU . . . . . 0.653 HD21 ' OG ' ' A' ' 38' ' ' SER . 13.3 mt . . . . . 0 C--N 1.328 -0.338 0 CA-C-N 116.163 -0.471 . . . . 73.03 110.866 -179.917 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 18.5 tt0 . . . . . 0 C--O 1.232 0.157 0 CA-C-O 120.801 0.334 . . . . 60.31 110.883 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 60.5 mt -65.56 -37.12 79.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.242 -0.435 . . . . 65.44 111.167 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -54.6 -51.83 64.1 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.176 -0.465 . . . . 72.32 111.126 179.784 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -62.34 -49.2 76.52 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.174 -0.466 . . . . 72.5 110.918 -179.959 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.534 ' HB3' HD13 ' A' ' 69' ' ' LEU . 14.2 m-85 -55.85 -45.82 78.34 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.155 -0.475 . . . . 63.53 110.849 -179.941 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 26.6 ttpt -55.46 -25.95 39.47 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.163 -0.472 . . . . 64.14 110.927 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 16.2 tt0 -75.11 -31.07 61.05 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.178 -0.465 . . . . 75.43 110.856 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -70.67 -33.41 70.91 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.14 -0.482 . . . . 61.02 111.096 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 93.9 t80 -75.56 -54.21 7.37 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.232 -0.44 . . . . 65.31 110.886 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 17.4 t -53.23 -29.56 33.21 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.134 -0.485 . . . . 52.43 110.888 -179.827 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.42 HD23 ' CB ' ' M' ' 38' ' ' SER . 16.1 tp -63.58 -41.82 98.33 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.114 -0.494 . . . . 73.13 110.873 -179.954 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.695 ' CD1' HG11 ' A' ' 35' ' ' VAL . 20.1 m-85 -77.55 -30.9 52.95 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.194 -0.457 . . . . 72.04 110.9 179.96 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 13.3 t0 -76.96 98.62 4.99 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.124 -0.489 . . . . 73.42 110.877 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 6.2 tptt -66.47 -49.93 64.99 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.186 -0.461 . . . . 72.25 110.938 179.948 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 24.7 p-10 -81.87 -10.2 59.38 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.237 -0.438 . . . . 75.03 110.852 179.878 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 51.59 44.84 54.33 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.773 -0.727 . . . . 73.31 112.427 -179.97 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 29.4 p-10 -88.32 -15.52 35.48 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.852 0.358 . . . . 74.23 110.897 179.989 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 105.45 -11.63 47.1 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.746 -0.74 . . . . 64.44 112.474 -179.943 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 32.8 p -130.4 130.6 44.55 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.734 0.302 . . . . 54.11 111.159 -179.831 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 24.2 mt -96.34 112.64 28.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.236 -0.438 . . . . 65.42 111.143 179.924 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.54 HG22 HG21 ' A' ' 62' ' ' THR . 21.0 p -95.57 175.52 6.52 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.199 -0.455 . . . . 63.12 111.162 179.932 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.637 HG22 HD12 ' A' ' 52' ' ' ILE . 60.4 p -60.35 -37.2 79.92 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.23 -0.441 . . . . 63.54 111.154 -179.988 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 19.9 mmmt -60.23 -50.11 74.95 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.209 -0.451 . . . . 74.44 110.932 179.857 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.672 ' O ' HG23 ' A' ' 35' ' ' VAL . 51.5 mt-10 -72.11 -32.73 67.25 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.213 -0.448 . . . . 64.2 110.876 179.986 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.535 HD13 ' O ' ' A' ' 32' ' ' LEU . 1.1 tm? -67.83 -44.48 77.12 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.145 -0.479 . . . . 60.42 110.951 179.99 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -71.7 -27.94 70.03 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.721 -0.752 . . . . 43.41 112.532 179.87 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 96.5 m -70.31 -53.64 15.95 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.867 0.365 . . . . 73.31 111.128 -179.869 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.695 HG11 ' CD1' ' A' ' 19' ' ' PHE . 46.8 t -52.53 -51.7 32.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.189 -0.459 . . . . 75.32 111.105 179.937 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' MET . . . . . 0.569 ' HE3' HG13 ' M' ' 34' ' ' ILE . 0.0 OUTLIER -51.89 -39.41 58.99 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.174 -0.466 . . . . 74.22 110.895 179.919 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 21.7 ttt-85 -57.01 -44.67 83.05 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.241 -0.436 . . . . 73.44 110.824 -179.894 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' SER . . . . . 0.621 ' OG ' HD11 ' M' ' 41' ' ' LEU . 1.1 p -67.49 -26.34 66.31 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.217 -0.447 . . . . 64.54 110.835 -179.74 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.966 HD13 ' HB3' ' M' ' 37' ' ' ALA . 48.7 mt -85.64 -21.39 28.44 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.084 -0.507 . . . . 70.22 110.927 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 101.44 31.14 5.64 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.736 -0.745 . . . . 73.32 112.498 179.941 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 10.6 mt-30 -119.56 122.69 42.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.777 0.322 . . . . 44.12 110.94 -179.896 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 22.7 t-20 -109.86 76.84 0.99 Allowed Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 121.627 0.727 . . . . 73.21 110.918 -179.977 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' PRO . . . . . 0.541 ' HG2' HD21 ' A' ' 48' ' ' LEU . 53.9 Cg_endo -69.76 140.23 42.19 Favored 'Trans proline' 0 C--N 1.342 0.196 0 C-N-CA 122.68 2.253 . . . . 73.12 112.359 179.938 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 29.6 p -72.64 161.63 30.53 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.209 -0.45 . . . . 62.51 111.154 -179.976 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 67.9 tt0 -52.04 -42.9 63.47 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.22 -0.446 . . . . 72.25 110.919 179.978 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.0 -31.54 64.56 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.184 -0.462 . . . . 72.33 111.131 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 55.5 tt0 -66.22 -50.48 63.69 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.157 -0.474 . . . . 74.42 110.872 -179.915 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.541 HD21 ' HG2' ' A' ' 43' ' ' PRO . 40.5 mt -55.17 -47.12 75.62 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.153 -0.476 . . . . 75.14 110.908 -179.954 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -66.42 -29.03 69.09 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.203 -0.453 . . . . 73.51 110.847 179.96 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 37.9 t0 -70.68 -49.57 45.88 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.26 -0.427 . . . . 74.21 110.877 179.945 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 31.8 mtp -59.54 -57.98 10.6 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.174 -0.466 . . . . 75.4 110.874 179.997 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.637 HD12 HG22 ' A' ' 29' ' ' THR . 61.7 mt -53.29 -43.82 51.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.181 -0.463 . . . . 73.52 111.108 179.985 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 71.7 m-20 -64.0 -38.84 92.54 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.145 -0.48 . . . . 65.42 110.906 179.952 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -60.62 -32.08 71.24 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.185 -0.462 . . . . 72.45 110.889 179.988 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 26.5 m -105.31 14.7 7.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.141 -0.481 . . . . 74.11 111.118 -180.0 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 31.0 t0 -90.07 100.19 13.06 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.201 -0.454 . . . . 51.22 110.874 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.23 -45.85 9.73 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.206 -0.452 . . . . 64.23 111.084 179.995 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 16.8 p-10 -81.67 -0.19 41.55 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.246 -0.433 . . . . 73.42 110.87 179.952 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 53.42 56.15 21.15 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.743 -0.742 . . . . 63.42 112.473 -179.978 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 52.0 p-10 -114.49 -15.71 12.01 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.858 0.361 . . . . 73.3 110.907 -179.903 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 91.73 15.59 54.26 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.743 -0.741 . . . . 71.24 112.525 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' THR . . . . . 0.54 HG21 HG22 ' A' ' 28' ' ' THR . 40.0 p -148.01 163.75 35.9 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.776 0.322 . . . . 74.25 111.139 -179.843 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 24.2 mt -99.9 109.5 24.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.2 -0.454 . . . . 75.23 111.141 179.868 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 4.6 t0 -75.42 -172.97 1.94 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.155 -0.475 . . . . 71.05 110.831 179.863 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.53 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 2.5 t80 -65.68 -58.42 11.62 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 121.618 0.723 . . . . 74.24 110.891 -179.886 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 66' ' ' PRO . . . . . 0.53 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 54.1 Cg_endo -69.74 -25.5 28.65 Favored 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.667 2.245 . . . . 52.01 112.376 179.961 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 17.4 mt-10 -61.61 -43.57 98.62 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.222 -0.444 . . . . 63.33 110.871 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 21.7 t80 -71.21 -36.21 71.8 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.172 -0.467 . . . . 72.22 110.921 -179.958 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.534 HD13 ' HB3' ' A' ' 12' ' ' PHE . 21.4 tp -62.56 -53.79 49.46 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.133 -0.485 . . . . 74.24 110.901 179.989 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 9.9 t -60.48 -30.96 70.02 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.146 -0.479 . . . . 60.53 111.116 179.951 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 7.9 tmm? -61.45 -46.76 88.74 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.233 -0.439 . . . . 74.41 110.902 179.914 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -76.07 -48.57 20.32 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.216 -0.447 . . . . 75.1 110.886 179.948 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.321 0 CA-C-N 116.267 -0.424 . . . . 53.51 111.107 179.923 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.422 HG21 HG22 ' A' ' 142' ' ' VAL . 67.3 mt . . . . . 0 C--O 1.232 0.139 0 CA-C-O 120.775 0.322 . . . . 75.53 111.115 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.06 -32.03 71.22 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.195 -0.457 . . . . 74.43 110.843 179.991 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.706 ' O ' HG23 ' A' ' 91' ' ' VAL . 8.3 tm-20 -75.67 -51.67 12.24 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.177 -0.465 . . . . 71.13 110.85 -179.881 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -54.73 -50.96 67.11 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.163 -0.472 . . . . 42.51 111.069 179.957 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 22.2 t80 -53.47 -44.49 69.01 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.207 -0.451 . . . . 75.53 110.839 -179.862 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 1.6 tmm_? -66.64 -46.04 77.05 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.176 -0.465 . . . . 72.24 110.889 -179.938 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 91' ' ' VAL . . . . . 0.706 HG23 ' O ' ' A' ' 87' ' ' GLU . 91.6 t -54.42 -51.02 53.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.18 -0.463 . . . . 75.52 111.11 -179.994 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.575 ' CE1' HG11 ' A' ' 108' ' ' VAL . 19.6 m-85 -66.13 -27.1 67.78 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.194 -0.457 . . . . 73.14 110.866 -179.978 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 31.4 t0 -69.67 95.21 0.85 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.13 -0.487 . . . . 60.44 110.855 179.989 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 5.7 mptp? -78.42 -52.59 8.33 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.198 -0.455 . . . . 73.34 110.865 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 44.2 p30 -72.63 -9.04 58.12 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.235 -0.438 . . . . 64.04 110.902 179.867 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 59.68 27.05 63.35 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.715 -0.755 . . . . 75.34 112.509 -179.951 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 40.0 p-10 -82.06 -16.19 50.98 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.847 0.356 . . . . 73.33 110.882 -179.928 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 84.79 18.67 61.1 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.683 -0.77 . . . . 55.23 112.517 179.978 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 20.6 m-85 -140.66 135.26 31.49 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.856 0.36 . . . . 73.42 110.936 -179.787 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 66.2 mt -102.27 126.83 56.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.125 -0.489 . . . . 75.5 111.164 179.908 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 28.7 p -111.66 -174.59 2.5 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.198 -0.456 . . . . 63.42 110.844 -179.891 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 102' ' ' ALA . . . . . 0.601 ' O ' HG11 ' A' ' 121' ' ' VAL . . . -71.2 -34.5 70.91 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.113 -0.494 . . . . 64.11 111.116 179.915 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -71.98 -44.83 62.88 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.209 -0.45 . . . . 75.32 111.089 179.935 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -69.09 -50.13 51.01 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.229 -0.441 . . . . 73.03 110.914 -179.934 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 42.5 tp -52.94 -33.3 50.22 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.183 -0.462 . . . . 74.54 110.94 179.991 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 106' ' ' ARG . . . . . 0.644 ' HB2' HG21 ' A' ' 121' ' ' VAL . 58.4 ttp85 -73.74 -36.95 65.22 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.202 -0.453 . . . . 61.24 110.896 179.943 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 2.0 t60 -54.34 -38.11 65.66 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.123 -0.49 . . . . 75.13 110.892 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.575 HG11 ' CE1' ' A' ' 92' ' ' PHE . 23.3 t -69.86 -48.14 65.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.162 -0.472 . . . . 64.23 111.137 179.961 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 109' ' ' MET . . . . . 0.464 ' HB3' HD12 ' A' ' 116' ' ' LEU . 2.4 mmt -59.72 -38.27 81.22 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.196 -0.456 . . . . 73.51 110.902 179.906 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 8.0 m -52.25 -43.03 64.13 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.218 -0.446 . . . . 65.33 111.176 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -68.34 -28.91 67.56 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.203 -0.453 . . . . 65.25 110.874 179.978 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.433 ' O ' HD23 ' A' ' 112' ' ' LEU . 1.1 tt -70.87 -26.12 63.11 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.207 -0.452 . . . . 63.54 110.893 179.96 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 99.81 30.57 6.38 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.712 -0.756 . . . . 52.24 112.476 179.921 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -115.87 113.39 23.28 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.892 0.377 . . . . 75.52 110.884 -179.856 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 14.9 pttp -64.19 116.24 5.79 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.187 -0.46 . . . . 73.55 110.91 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.464 HD12 ' HB3' ' A' ' 109' ' ' MET . 14.2 mt -145.25 133.36 21.5 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.231 -0.441 . . . . 75.31 110.893 179.964 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 117' ' ' THR . . . . . 0.653 ' O ' HG23 ' A' ' 121' ' ' VAL . 27.8 p -107.42 -177.13 3.26 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.167 -0.469 . . . . 72.4 111.153 179.994 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -58.91 -37.78 77.43 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.264 -0.425 . . . . 75.03 110.826 179.907 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 61.5 tt0 -73.91 -33.92 64.18 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.181 -0.463 . . . . 63.53 110.86 -179.895 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 120' ' ' GLU . . . . . 0.41 ' HG2' HD22 ' A' ' 116' ' ' LEU . 10.4 tt0 -74.06 -37.21 64.32 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.172 -0.467 . . . . 73.0 110.874 -179.901 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.653 HG23 ' O ' ' A' ' 117' ' ' THR . 61.0 t -74.29 -31.0 27.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.137 -0.483 . . . . 74.04 111.106 179.991 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -52.01 -45.32 64.5 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.172 -0.467 . . . . 71.22 110.864 179.903 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 21.5 tp10 -56.07 -29.69 60.9 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.186 -0.461 . . . . 52.13 110.887 -179.893 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 124' ' ' MET . . . . . 0.421 ' HE3' ' HB3' ' M' ' 15' ' ' LYS . 14.6 mtp -75.06 -57.39 3.93 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.161 -0.472 . . . . 70.45 110.823 179.985 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.444 HG13 ' HB2' ' A' ' 102' ' ' ALA . 35.8 mm -53.88 -35.65 28.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.233 -0.439 . . . . 71.41 111.151 -179.992 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 22.1 ttp85 -63.38 -31.8 73.05 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.125 -0.489 . . . . 70.32 110.861 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 20.0 tp10 -75.01 -52.41 11.15 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.21 -0.45 . . . . 70.55 110.861 -179.922 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.674 ' HB3' HG22 ' A' ' 136' ' ' VAL . . . -64.96 -34.41 78.37 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.175 -0.466 . . . . 63.11 111.106 179.952 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 49.2 t0 -68.42 86.67 0.29 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.208 -0.451 . . . . 61.13 110.888 179.96 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 58.0 mt -79.8 -46.34 22.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.218 -0.446 . . . . 63.24 111.139 179.997 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 21.2 p30 -72.66 -8.74 56.83 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.225 -0.443 . . . . 72.35 110.87 179.837 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 62.79 42.97 99.59 Favored Glycine 0 N--CA 1.452 -0.245 0 C-N-CA 120.738 -0.744 . . . . 40.53 112.456 -179.912 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 34.6 p-10 -88.07 -15.89 35.05 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.809 0.338 . . . . 71.44 110.879 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 104.11 2.25 45.11 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.709 -0.758 . . . . 74.3 112.514 -179.932 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 4.0 tt0 -149.14 172.24 15.13 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.852 0.358 . . . . 72.02 110.903 -179.876 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 136' ' ' VAL . . . . . 0.674 HG22 ' HB3' ' A' ' 128' ' ' ALA . 92.9 t -106.75 109.87 29.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.213 -0.449 . . . . 55.41 111.093 179.951 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 20.4 p30 -90.97 164.86 13.84 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.15 -0.477 . . . . 72.41 110.903 179.921 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 138' ' ' TYR . . . . . 0.603 ' O ' HG23 ' A' ' 142' ' ' VAL . 70.1 t80 -52.05 -46.72 65.19 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.135 -0.484 . . . . 72.52 110.922 -179.932 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 11.5 tm-20 -51.92 -39.98 60.02 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.148 -0.478 . . . . 70.21 110.873 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 22.5 mt-10 -78.41 -41.69 32.36 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.153 -0.476 . . . . 75.41 110.929 -179.923 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 64.6 t80 -59.29 -35.8 74.41 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.128 -0.487 . . . . 75.53 110.899 -179.957 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 142' ' ' VAL . . . . . 0.603 HG23 ' O ' ' A' ' 138' ' ' TYR . 91.4 t -71.28 -37.87 67.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.153 -0.476 . . . . 74.34 111.137 179.953 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 39.9 tp60 -73.94 -31.23 62.95 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.199 -0.455 . . . . 73.44 110.922 179.986 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 9.0 tpt -74.11 -56.54 4.79 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.2 -0.454 . . . . 73.14 110.877 179.948 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 12.3 ttm -61.48 -26.09 67.67 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.286 -0.415 . . . . 63.44 110.879 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 2.5 m . . . . . 0 C--N 1.329 -0.314 0 CA-C-N 116.229 -0.442 . . . . 70.44 111.107 -179.87 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' M' M ' 15' ' ' LYS . . . . . 0.421 ' HB3' ' HE3' ' A' ' 124' ' ' MET . 18.9 mttp . . . . . 0 C--O 1.232 0.135 0 CA-C-O 120.751 0.31 . . . . 54.52 110.871 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' M' M ' 16' ' ' TRP . . . . . 0.723 ' CE3' HD12 ' M' ' 19' ' ' ILE . 10.6 m95 -51.76 -46.91 64.26 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.247 -0.433 . . . . 75.51 110.944 179.904 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' M' M ' 17' ' ' GLU . . . . . . . . . . . . . 3.1 tm-20 -55.36 -27.1 45.09 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.189 -0.46 . . . . 75.34 110.889 -179.965 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' M' M ' 18' ' ' LYS . . . . . . . . . . . . . 8.7 ttmm -75.61 -28.93 59.05 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.127 -0.488 . . . . 74.21 110.891 179.995 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' M' M ' 19' ' ' ILE . . . . . 0.723 HD12 ' CE3' ' M' ' 16' ' ' TRP . 54.5 mt -78.95 -24.86 13.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.207 -0.451 . . . . 71.5 111.166 179.832 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' M' M ' 20' ' ' ARG . . . . . . . . . . . . . 48.7 ttp180 . . . . . 0 C--N 1.329 -0.287 0 CA-C-N 116.154 -0.475 . . . . 70.2 110.851 179.996 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' M' M ' 30' ' ' LYS . . . . . . . . . . . . . 2.1 ptmt . . . . . 0 C--O 1.232 0.167 0 CA-C-O 120.759 0.314 . . . . 54.42 110.864 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' M' M ' 31' ' ' LEU . . . . . 0.536 HD12 ' O ' ' M' ' 31' ' ' LEU . 10.0 tp -118.87 -31.38 4.8 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.233 -0.439 . . . . 63.31 110.945 179.937 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' M' M ' 32' ' ' LYS . . . . . 0.401 ' O ' HG23 ' M' ' 35' ' ' VAL . 5.4 mtpm? -49.89 -44.61 50.08 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.155 -0.475 . . . . 73.43 110.89 179.821 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' M' M ' 33' ' ' HIS . . . . . . . . . . . . . 3.6 t60 -50.71 -37.31 40.72 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.272 -0.422 . . . . 71.3 110.839 179.909 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' M' M ' 34' ' ' ILE . . . . . 0.569 HG13 ' HE3' ' A' ' 36' ' ' MET . 49.3 mm -50.27 -39.65 16.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.197 -0.456 . . . . 65.52 111.12 179.977 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' M' M ' 35' ' ' VAL . . . . . 0.401 HG23 ' O ' ' M' ' 32' ' ' LYS . 40.1 t -49.31 -39.95 13.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.159 -0.473 . . . . 73.41 111.123 179.876 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' M' M ' 36' ' ' TRP . . . . . . . . . . . . . 24.8 m0 -58.78 -39.45 81.07 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.173 -0.467 . . . . 75.23 110.96 179.964 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' M' M ' 37' ' ' ALA . . . . . 0.966 ' HB3' HD13 ' A' ' 39' ' ' LEU . . . -64.1 -18.62 64.57 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.257 -0.429 . . . . 74.3 111.084 179.851 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' M' M ' 38' ' ' SER . . . . . 0.42 ' CB ' HD23 ' A' ' 18' ' ' LEU . 0.7 OUTLIER -73.29 -17.92 61.26 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.227 -0.442 . . . . 74.15 110.877 -179.782 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' M' M ' 39' ' ' ARG . . . . . . . . . . . . . 22.5 mmm180 -62.76 -25.18 68.08 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.149 -0.478 . . . . 71.1 110.837 -179.94 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' M' M ' 40' ' ' GLU . . . . . . . . . . . . . 7.0 mp0 -77.21 -48.03 18.66 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.211 -0.45 . . . . 73.4 110.898 -179.917 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' M' M ' 41' ' ' LEU . . . . . 0.621 HD11 ' OG ' ' A' ' 38' ' ' SER . 18.0 mt . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 116.103 -0.499 . . . . 60.4 110.904 -179.932 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 19.3 tt0 . . . . . 0 C--O 1.232 0.137 0 CA-C-O 120.794 0.33 . . . . 74.21 110.864 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 64.2 mt -69.84 -37.23 72.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.186 -0.461 . . . . 74.25 111.139 179.951 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -52.16 -50.81 61.06 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.203 -0.453 . . . . 43.52 111.097 179.831 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 17.5 mt-10 -57.02 -52.22 66.14 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.187 -0.46 . . . . 65.03 110.847 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.526 ' CB ' HD13 ' A' ' 69' ' ' LEU . 45.7 m-85 -58.02 -42.36 85.09 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.206 -0.452 . . . . 75.13 110.879 -179.907 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 21.7 ttpp -51.88 -41.26 61.77 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.114 -0.494 . . . . 74.14 110.932 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 56.5 tt0 -62.81 -32.87 74.15 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.261 -0.427 . . . . 74.51 110.829 180.0 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -68.91 -37.63 79.07 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.15 -0.477 . . . . 74.31 111.062 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 89.8 t80 -69.96 -53.22 18.77 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.257 -0.429 . . . . 75.31 110.912 -179.911 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 1.7 t -52.04 -35.79 48.3 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.153 -0.476 . . . . 71.23 110.855 -179.824 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 18.7 tp -59.81 -45.71 91.48 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.129 -0.487 . . . . 73.54 110.931 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.648 ' CD1' HG11 ' A' ' 35' ' ' VAL . 20.8 m-85 -73.07 -34.08 66.02 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.193 -0.458 . . . . 74.02 110.88 179.911 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 9.6 t0 -76.37 98.43 4.53 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.175 -0.466 . . . . 72.42 110.897 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 3.0 ttmp? -71.38 -55.73 7.39 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.188 -0.46 . . . . 72.23 110.903 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 22.3 p-10 -74.82 -10.04 59.12 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.227 -0.442 . . . . 74.41 110.863 179.867 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 52.25 44.26 57.67 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.732 -0.747 . . . . 72.04 112.486 -179.934 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 35.7 p-10 -89.58 -15.8 32.05 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.88 0.371 . . . . 70.41 110.893 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 103.92 -11.63 52.67 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.716 -0.754 . . . . 71.41 112.501 -179.906 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 19.8 p -128.01 133.26 49.13 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.736 0.303 . . . . 70.33 111.144 -179.866 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 24.5 mt -103.94 111.54 33.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.22 -0.445 . . . . 64.44 111.119 179.934 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.697 HG22 HG21 ' A' ' 62' ' ' THR . 20.3 p -94.81 -179.73 4.95 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.158 -0.474 . . . . 61.2 111.138 179.991 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 65.3 p -61.05 -32.04 71.67 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.185 -0.461 . . . . 75.35 111.164 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 24.1 tptm -68.31 -50.11 55.76 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.18 -0.463 . . . . 70.4 110.921 179.867 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.481 ' O ' HG23 ' A' ' 35' ' ' VAL . 35.9 mt-10 -70.33 -32.7 70.55 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.208 -0.451 . . . . 44.31 110.907 179.937 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.845 HD12 HD22 ' A' ' 48' ' ' LEU . 0.9 OUTLIER -74.14 -41.2 61.93 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.145 -0.48 . . . . 71.44 110.917 -179.963 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -71.72 -41.01 57.57 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.738 -0.744 . . . . 73.51 112.478 179.902 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 97.3 m -56.69 -56.43 21.47 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.82 0.343 . . . . 73.55 111.079 -179.839 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.648 HG11 ' CD1' ' A' ' 19' ' ' PHE . 91.9 t -52.01 -44.78 39.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.227 -0.442 . . . . 74.35 111.117 179.953 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 6.1 mmm -56.38 -34.46 66.7 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.173 -0.467 . . . . 54.02 110.913 179.874 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 35.9 ttp85 -57.53 -55.26 37.12 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.195 -0.457 . . . . 72.11 110.899 -179.912 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' SER . . . . . 0.589 ' OG ' HD21 ' M' ' 41' ' ' LEU . 3.4 t -59.09 -27.0 65.15 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.205 -0.452 . . . . 71.03 110.842 -179.825 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.957 HD13 ' HB3' ' M' ' 37' ' ' ALA . 55.7 mt -78.98 -16.46 56.9 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.176 -0.466 . . . . 64.14 110.957 179.986 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 101.55 26.38 7.69 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.751 -0.738 . . . . 41.21 112.461 179.881 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 17.3 mt-30 -133.38 123.06 24.7 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.801 0.334 . . . . 70.23 110.92 -179.878 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 2.0 t30 -109.82 76.9 0.99 Allowed Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.6 0.714 . . . . 71.15 110.9 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' PRO . . . . . 0.656 ' CG ' HD21 ' A' ' 48' ' ' LEU . 53.8 Cg_endo -69.79 161.81 44.51 Favored 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.651 2.234 . . . . 75.33 112.344 179.94 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 34.1 p -100.14 168.74 9.62 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.195 -0.457 . . . . 74.43 111.12 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 4.4 mp0 -54.43 -51.1 66.0 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.171 -0.468 . . . . 74.4 110.861 -179.972 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -67.28 -31.5 71.87 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.174 -0.467 . . . . 71.43 111.143 179.931 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -65.35 -46.77 78.87 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.199 -0.455 . . . . 73.13 110.866 -179.941 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.845 HD22 HD12 ' A' ' 32' ' ' LEU . 18.3 mt -67.78 -51.9 43.48 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.188 -0.46 . . . . 71.42 110.922 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 5.7 tp-100 -52.91 -28.49 23.59 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.217 -0.447 . . . . 63.13 110.962 179.901 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -64.42 -49.83 70.0 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.159 -0.473 . . . . 63.3 110.888 179.973 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 6.1 ptp -76.35 -35.71 58.57 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.175 -0.466 . . . . 62.23 110.882 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 81.8 mt -66.09 -38.35 81.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.205 -0.452 . . . . 70.14 111.138 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 28.0 m-20 -63.59 -43.23 97.55 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.125 -0.489 . . . . 74.35 110.836 179.998 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -57.9 -43.54 86.23 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.204 -0.453 . . . . 73.14 110.856 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 36.0 m -81.56 -13.14 12.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.197 -0.456 . . . . 74.43 111.124 179.977 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 38.2 t0 -66.89 97.61 0.49 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.198 -0.456 . . . . 73.44 110.82 179.973 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.19 -44.31 10.98 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.156 -0.475 . . . . 65.33 111.132 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 9.3 p-10 -81.74 -0.17 41.76 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.207 -0.451 . . . . 74.22 110.837 179.998 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 54.51 57.37 17.7 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.716 -0.754 . . . . 70.4 112.507 -179.942 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 52.1 p-10 -114.53 -15.81 11.97 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.859 0.361 . . . . 63.43 110.852 -179.848 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 93.82 15.89 47.39 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.744 -0.741 . . . . 63.15 112.453 179.963 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' THR . . . . . 0.697 HG21 HG22 ' A' ' 28' ' ' THR . 44.6 p -148.84 175.34 11.34 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.763 0.316 . . . . 73.12 111.13 -179.857 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 19.2 mt -107.84 109.78 29.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.197 -0.456 . . . . 74.01 111.161 179.897 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.4 t0 -75.28 -172.93 1.88 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.181 -0.463 . . . . 75.41 110.818 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.531 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 2.5 t80 -65.29 -58.28 12.68 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-O 121.635 0.731 . . . . 75.14 110.888 -179.933 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 66' ' ' PRO . . . . . 0.531 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 53.6 Cg_endo -69.76 -26.42 27.6 Favored 'Trans proline' 0 C--N 1.341 0.146 0 C-N-CA 122.649 2.233 . . . . 74.43 112.364 -179.994 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 20.3 mt-10 -62.07 -40.57 96.26 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.199 -0.455 . . . . 75.11 110.891 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 17.2 t80 -74.36 -35.86 63.57 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.158 -0.474 . . . . 75.1 110.903 -179.925 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.526 HD13 ' CB ' ' A' ' 12' ' ' PHE . 33.6 tp -69.92 -53.9 15.79 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.098 -0.501 . . . . 64.34 110.916 -179.958 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 14.0 t -53.29 -30.69 40.1 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.175 -0.466 . . . . 73.25 111.155 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 36.2 ttp -58.79 -50.62 73.27 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.222 -0.444 . . . . 71.1 110.856 179.956 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 1.4 mmt -66.08 -48.81 69.74 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.263 -0.426 . . . . 72.23 110.891 179.932 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.309 0 CA-C-N 116.262 -0.426 . . . . 72.41 111.055 179.904 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.834 HG21 HG22 ' A' ' 142' ' ' VAL . 56.3 mt . . . . . 0 C--O 1.231 0.101 0 CA-C-O 120.805 0.336 . . . . 75.42 111.08 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 44.8 ttp180 -53.99 -33.49 57.2 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.188 -0.46 . . . . 72.25 110.843 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.716 ' O ' HG23 ' A' ' 91' ' ' VAL . 28.2 tt0 -76.63 -57.45 3.85 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.215 -0.448 . . . . 73.31 110.858 -179.879 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -53.53 -48.54 68.96 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.15 -0.477 . . . . 61.14 111.113 179.938 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 7.0 t80 -52.02 -51.26 58.57 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.21 -0.45 . . . . 71.12 110.855 -179.942 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 2.1 tmt_? -62.52 -46.95 86.05 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.166 -0.47 . . . . 72.3 110.891 -179.892 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 91' ' ' VAL . . . . . 0.716 HG23 ' O ' ' A' ' 87' ' ' GLU . 87.8 t -51.88 -47.91 40.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.189 -0.46 . . . . 71.45 111.143 179.941 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 18.6 m-85 -73.57 -26.48 60.85 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.148 -0.478 . . . . 64.41 110.889 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 31.6 t0 -69.77 95.2 0.87 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.118 -0.492 . . . . 73.5 110.854 179.985 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -78.65 -52.51 8.33 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.188 -0.46 . . . . 72.24 110.89 -179.998 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 53.6 p30 -72.66 -9.16 58.28 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.213 -0.448 . . . . 53.43 110.862 179.91 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 59.87 28.0 65.24 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.711 -0.757 . . . . 53.25 112.492 -179.955 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 46.0 p-10 -82.08 -16.14 51.06 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.871 0.367 . . . . 64.04 110.894 -179.859 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 88.1 18.66 55.39 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.743 -0.742 . . . . 25.54 112.507 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 12.9 m-85 -138.89 151.98 47.39 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.862 0.363 . . . . 74.41 110.911 -179.782 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 70.8 mt -115.73 122.34 69.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.154 -0.476 . . . . 65.44 111.167 179.907 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 53.4 p -114.81 -172.58 2.15 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.191 -0.459 . . . . 72.23 110.871 -179.877 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -74.75 -39.77 61.64 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.179 -0.464 . . . . 74.22 111.154 179.872 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -62.72 -39.98 95.77 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.188 -0.46 . . . . 55.2 111.09 179.906 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 21.6 mt-10 -76.95 -46.75 23.05 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.217 -0.447 . . . . 75.32 110.863 -179.89 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 29.7 tp -53.16 -43.97 67.46 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.136 -0.484 . . . . 74.4 110.926 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 106' ' ' ARG . . . . . 0.45 ' O ' HG23 ' A' ' 110' ' ' THR . 21.7 ttt-85 -51.99 -39.13 58.92 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.175 -0.466 . . . . 70.31 110.868 179.933 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 16.3 t60 -63.3 -35.53 80.67 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.192 -0.458 . . . . 70.12 110.847 -179.965 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 90.7 t -70.04 -52.29 32.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.218 -0.446 . . . . 50.33 111.143 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 109' ' ' MET . . . . . 0.461 ' HB3' HD12 ' A' ' 116' ' ' LEU . 1.6 mmt -61.46 -44.68 96.67 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.172 -0.467 . . . . 74.11 110.849 179.906 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 110' ' ' THR . . . . . 0.45 HG23 ' O ' ' A' ' 106' ' ' ARG . 12.9 p -53.01 -32.78 48.5 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.249 -0.432 . . . . 72.44 111.17 -179.871 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 8.9 t30 -74.62 -31.01 61.86 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.209 -0.451 . . . . 72.04 110.868 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.424 ' O ' HD23 ' A' ' 112' ' ' LEU . 1.1 tt -70.7 -26.07 63.25 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.193 -0.458 . . . . 72.5 110.925 179.966 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 100.12 23.28 10.69 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.758 -0.734 . . . . 61.21 112.468 179.928 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 54.7 tp10 -104.3 115.58 30.63 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.894 0.378 . . . . 75.33 110.88 -179.861 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 115' ' ' LYS . . . . . 0.464 ' O ' HD23 ' A' ' 116' ' ' LEU . 14.0 pttp -64.82 117.77 8.01 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.156 -0.475 . . . . 75.03 110.884 179.968 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.464 HD23 ' O ' ' A' ' 115' ' ' LYS . 17.2 mt -146.75 130.66 17.16 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.196 -0.456 . . . . 73.43 110.912 179.901 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 117' ' ' THR . . . . . 0.475 ' O ' HG23 ' A' ' 121' ' ' VAL . 32.6 p -92.13 170.9 9.46 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.162 -0.472 . . . . 71.12 111.193 179.964 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 60.3 m-20 -53.24 -43.37 67.28 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.262 -0.426 . . . . 74.0 110.909 179.867 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 16.5 tp10 -65.55 -35.02 79.62 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.187 -0.461 . . . . 73.31 110.837 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 120' ' ' GLU . . . . . 0.422 ' HG2' HD22 ' A' ' 116' ' ' LEU . 2.2 tp10 -65.97 -40.72 91.5 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.178 -0.464 . . . . 71.44 110.859 -179.875 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.475 HG23 ' O ' ' A' ' 117' ' ' THR . 30.6 t -61.29 -38.94 80.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.147 -0.479 . . . . 74.02 111.164 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -52.02 -48.92 64.27 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.138 -0.483 . . . . 73.4 110.836 179.946 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -56.22 -29.3 60.78 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.203 -0.453 . . . . 74.14 110.859 -179.905 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 124' ' ' MET . . . . . 0.465 ' HE1' HD11 ' M' ' 19' ' ' ILE . 0.1 OUTLIER -73.37 -59.62 2.62 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.191 -0.459 . . . . 64.44 110.831 179.997 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.44 HG23 HG23 ' A' ' 136' ' ' VAL . 33.0 mm -54.06 -35.81 29.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.238 -0.437 . . . . 55.24 111.134 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 69.2 ttt180 -63.44 -31.77 73.03 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.163 -0.471 . . . . 73.23 110.921 179.906 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 6.7 tp10 -71.43 -44.34 65.04 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.21 -0.45 . . . . 73.2 110.934 -179.959 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.714 ' HB3' HG22 ' A' ' 136' ' ' VAL . . . -76.06 -26.58 56.68 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.113 -0.494 . . . . 70.52 111.085 179.94 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 43.1 t0 -68.04 87.52 0.26 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.189 -0.46 . . . . 74.42 110.88 179.991 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 130' ' ' ILE . . . . . 0.42 HD12 ' HG2' ' A' ' 140' ' ' GLU . 60.8 mt -79.91 -49.33 19.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.175 -0.466 . . . . 70.51 111.126 -179.978 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 18.8 p30 -72.91 -8.7 56.82 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.167 -0.47 . . . . 72.2 110.841 179.842 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 63.9 44.67 95.73 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.751 -0.738 . . . . 71.12 112.521 -179.907 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 35.8 p-10 -91.18 -15.88 28.6 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.884 0.373 . . . . 65.12 110.862 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 104.19 2.33 44.86 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.758 -0.734 . . . . 72.12 112.457 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 2.7 tt0 -149.19 172.2 15.22 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.775 0.321 . . . . 60.41 110.935 -179.9 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 136' ' ' VAL . . . . . 0.714 HG22 ' HB3' ' A' ' 128' ' ' ALA . 61.6 t -105.63 109.74 28.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.176 -0.466 . . . . 41.42 111.142 179.938 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 23.1 p30 -89.09 165.46 14.49 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.167 -0.47 . . . . 71.33 110.934 179.948 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 138' ' ' TYR . . . . . 0.62 ' O ' HG23 ' A' ' 142' ' ' VAL . 87.1 t80 -52.05 -47.2 65.21 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.158 -0.474 . . . . 72.31 110.921 -179.898 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -52.01 -37.98 55.21 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.144 -0.48 . . . . 64.34 110.881 179.998 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 140' ' ' GLU . . . . . 0.42 ' HG2' HD12 ' A' ' 130' ' ' ILE . 19.4 mt-10 -78.39 -47.72 17.03 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.149 -0.478 . . . . 73.31 110.875 -179.906 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 65.2 t80 -54.33 -36.24 63.55 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.152 -0.476 . . . . 73.32 110.912 -179.936 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 142' ' ' VAL . . . . . 0.834 HG22 HG21 ' A' ' 85' ' ' ILE . 90.0 t -70.81 -43.04 77.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.147 -0.479 . . . . 42.13 111.16 179.93 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 20.5 tt0 -68.35 -29.98 68.83 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.162 -0.472 . . . . 73.44 110.872 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 7.9 tpt -72.03 -56.6 5.35 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.254 -0.43 . . . . 61.33 110.897 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 9.7 ttm -65.91 -26.06 67.44 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.256 -0.429 . . . . 65.24 110.891 179.927 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 2.1 m . . . . . 0 C--N 1.329 -0.294 0 CA-C-N 116.238 -0.437 . . . . 73.33 111.135 -179.92 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' M' M ' 15' ' ' LYS . . . . . 0.42 ' HB3' ' HE3' ' A' ' 124' ' ' MET . 20.4 mtmm . . . . . 0 C--O 1.231 0.12 0 CA-C-O 120.731 0.301 . . . . 63.14 110.877 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' M' M ' 16' ' ' TRP . . . . . 0.401 ' CE3' HD12 ' M' ' 19' ' ' ILE . 26.4 m95 -52.28 -43.13 64.27 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.242 -0.435 . . . . 71.22 110.899 179.948 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' M' M ' 17' ' ' GLU . . . . . . . . . . . . . 24.5 tt0 -54.48 -27.52 38.39 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.223 -0.444 . . . . 72.13 110.903 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' M' M ' 18' ' ' LYS . . . . . . . . . . . . . 15.8 ttpt -69.7 -30.6 68.27 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.157 -0.474 . . . . 62.15 110.899 179.961 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' M' M ' 19' ' ' ILE . . . . . 0.465 HD11 ' HE1' ' A' ' 124' ' ' MET . 43.9 mt -80.91 -25.02 10.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.22 -0.445 . . . . 64.51 111.13 179.867 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' M' M ' 20' ' ' ARG . . . . . . . . . . . . . 31.9 ttm180 . . . . . 0 C--N 1.329 -0.297 0 CA-C-N 116.206 -0.452 . . . . 71.42 110.881 179.973 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' M' M ' 30' ' ' LYS . . . . . . . . . . . . . 12.0 tttp . . . . . 0 C--O 1.232 0.154 0 CA-C-O 120.825 0.345 . . . . 74.5 110.867 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' M' M ' 31' ' ' LEU . . . . . 0.829 HD12 HD12 ' M' ' 34' ' ' ILE . 14.2 tp -70.62 -44.63 66.83 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.254 -0.43 . . . . 55.13 110.921 179.926 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' M' M ' 32' ' ' LYS . . . . . . . . . . . . . 5.7 mtmt -48.63 -44.87 37.73 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.182 -0.463 . . . . 75.45 110.894 179.851 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' M' M ' 33' ' ' HIS . . . . . . . . . . . . . 73.9 t60 -50.39 -39.33 46.65 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.227 -0.442 . . . . 74.1 110.843 179.898 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' M' M ' 34' ' ' ILE . . . . . 0.829 HD12 HD12 ' M' ' 31' ' ' LEU . 66.0 mt -50.6 -39.37 17.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.204 -0.453 . . . . 75.13 111.157 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' M' M ' 35' ' ' VAL . . . . . . . . . . . . . 39.8 t -49.36 -39.8 13.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.179 -0.464 . . . . 63.44 111.121 179.861 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' M' M ' 36' ' ' TRP . . . . . . . . . . . . . 24.2 m0 -58.71 -39.69 81.53 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.182 -0.463 . . . . 75.42 110.918 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' M' M ' 37' ' ' ALA . . . . . 0.957 ' HB3' HD13 ' A' ' 39' ' ' LEU . . . -63.87 -18.72 64.45 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.256 -0.429 . . . . 71.31 111.113 179.829 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' M' M ' 38' ' ' SER . . . . . . . . . . . . . 1.2 m -70.71 -17.91 62.81 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.266 -0.425 . . . . 73.53 110.873 -179.801 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' M' M ' 39' ' ' ARG . . . . . . . . . . . . . 37.2 mtp180 -53.29 -28.62 28.95 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.129 -0.487 . . . . 75.12 110.88 -179.916 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' M' M ' 40' ' ' GLU . . . . . . . . . . . . . 16.0 tp10 -85.98 -47.97 9.11 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.151 -0.477 . . . . 74.33 110.864 -179.912 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' M' M ' 41' ' ' LEU . . . . . 0.589 HD21 ' OG ' ' A' ' 38' ' ' SER . 10.5 mt . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 116.152 -0.476 . . . . 75.23 110.947 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.232 0.152 0 CA-C-O 120.775 0.321 . . . . 75.1 110.86 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 3.3 mp -72.19 -40.06 65.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.21 -0.45 . . . . 63.52 111.138 179.977 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -53.59 -32.09 49.6 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.215 -0.448 . . . . 55.01 111.057 179.831 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 27.3 mm-40 -74.79 -52.18 12.15 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.271 -0.422 . . . . 51.24 110.888 -179.894 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 38.1 m-85 -59.55 -45.97 90.24 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.134 -0.485 . . . . 74.42 110.889 -179.938 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 33.0 ttpt -53.87 -35.8 61.96 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.134 -0.485 . . . . 74.15 110.872 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -65.11 -30.85 71.82 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.269 -0.423 . . . . 73.42 110.913 179.978 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -70.68 -48.29 55.5 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.158 -0.474 . . . . 74.52 111.069 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 89.5 t80 -55.65 -54.24 46.59 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.221 -0.445 . . . . 73.03 110.887 -179.91 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 27.7 t -53.92 -29.56 42.67 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.109 -0.496 . . . . 74.22 110.874 -179.792 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 15.6 tp -65.72 -44.32 86.41 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.094 -0.503 . . . . 62.24 110.914 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.644 ' CD1' HG11 ' A' ' 35' ' ' VAL . 56.0 m-85 -75.71 -25.89 57.04 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.153 -0.476 . . . . 75.53 110.888 179.935 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 12.8 t0 -79.53 98.53 6.88 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.16 -0.473 . . . . 53.45 110.889 179.968 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 10.4 ttpp -67.11 -50.75 60.4 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.216 -0.447 . . . . 75.2 110.903 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 24.0 p-10 -81.0 -10.16 59.75 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.206 -0.452 . . . . 74.42 110.919 179.847 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 51.73 42.48 52.61 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.728 -0.749 . . . . 53.1 112.457 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 22.9 p-10 -88.51 -15.79 34.36 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.85 0.357 . . . . 55.52 110.854 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 102.18 17.64 19.65 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.715 -0.755 . . . . 41.02 112.477 -179.938 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -154.64 130.79 10.31 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.777 0.322 . . . . 73.43 111.127 -179.866 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 23.5 mt -97.73 122.38 49.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.167 -0.469 . . . . 72.22 111.12 179.915 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.583 HG22 HG21 ' A' ' 62' ' ' THR . 21.4 p -105.48 176.72 5.07 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.166 -0.47 . . . . 34.34 111.142 179.958 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 72.3 p -61.18 -29.34 69.74 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.239 -0.437 . . . . 71.14 111.129 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 28.4 mmtp -72.7 -49.97 27.9 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.202 -0.454 . . . . 73.04 110.883 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.42 ' O ' HG23 ' A' ' 35' ' ' VAL . 34.9 mt-10 -68.93 -32.68 72.48 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.21 -0.45 . . . . 75.03 110.896 179.988 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.546 HD13 ' O ' ' A' ' 32' ' ' LEU . 1.0 OUTLIER -71.52 -43.35 66.62 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.134 -0.484 . . . . 40.14 110.882 -179.978 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -70.26 -28.14 71.84 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.73 -0.747 . . . . 52.25 112.492 179.903 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 92.9 m -71.91 -58.21 3.65 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.826 0.346 . . . . 64.15 111.114 -179.851 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.644 HG11 ' CD1' ' A' ' 19' ' ' PHE . 96.0 t -51.62 -49.46 34.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.252 -0.431 . . . . 73.43 111.09 179.933 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 6.4 ttt -60.33 -39.31 86.6 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.199 -0.455 . . . . 72.03 110.868 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 51.4 ttp85 -52.74 -43.2 65.58 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.243 -0.435 . . . . 73.04 110.891 -179.944 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' SER . . . . . 0.562 ' OG ' HD21 ' M' ' 41' ' ' LEU . 1.7 t -70.28 -25.23 63.24 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.222 -0.445 . . . . 73.33 110.861 -179.8 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 1.004 HD13 ' HB3' ' M' ' 37' ' ' ALA . 57.1 mt -76.15 -20.92 57.14 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.108 -0.496 . . . . 74.11 110.932 179.981 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 101.48 30.01 6.07 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.771 -0.728 . . . . 71.15 112.511 179.916 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 15.4 mm-40 -128.9 122.56 30.54 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.829 0.347 . . . . 73.41 110.882 -179.897 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 33.7 t-20 -109.93 80.68 1.82 Allowed Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.589 0.709 . . . . 51.44 110.89 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.74 168.03 22.71 Favored 'Trans proline' 0 C--O 1.231 0.158 0 C-N-CA 122.671 2.247 . . . . 65.53 112.346 179.937 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 18.0 p -93.05 158.74 15.63 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.187 -0.46 . . . . 73.43 111.105 -179.938 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.3 pt-20 -51.66 -45.0 63.23 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.197 -0.456 . . . . 74.1 110.893 179.993 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -72.29 -31.32 65.62 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.16 -0.473 . . . . 42.42 111.088 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -69.98 -42.23 73.38 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.208 -0.451 . . . . 74.21 110.838 -179.853 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.51 HD23 HD12 ' A' ' 32' ' ' LEU . 15.1 mt -59.57 -50.98 71.79 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.187 -0.46 . . . . 71.22 110.932 179.969 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -71.91 -28.36 63.43 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.186 -0.461 . . . . 61.42 110.94 179.923 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 7.8 t0 -56.49 -49.8 73.64 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.18 -0.464 . . . . 74.4 110.813 179.978 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' MET . . . . . 0.461 ' HE1' HD11 ' M' ' 34' ' ' ILE . 6.7 ptp -69.49 -37.67 77.34 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.216 -0.447 . . . . 71.34 110.895 -179.957 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 96.5 mt -62.08 -52.48 59.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.191 -0.458 . . . . 73.41 111.126 179.928 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -55.06 -32.95 62.31 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.17 -0.468 . . . . 64.32 110.857 179.952 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -60.4 -55.29 35.36 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.185 -0.461 . . . . 74.13 110.852 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 17.2 m -77.12 -13.1 14.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.215 -0.448 . . . . 74.14 111.108 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 41.9 t0 -66.74 96.39 0.4 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.192 -0.458 . . . . 70.13 110.879 179.916 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.25 -36.81 16.52 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.217 -0.447 . . . . 71.32 111.08 179.959 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -86.45 -0.23 55.57 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.177 -0.465 . . . . 74.54 110.894 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 51.93 60.99 6.89 Favored Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.747 -0.739 . . . . 75.5 112.52 -179.946 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 51.5 p-10 -114.61 -15.89 11.92 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.814 0.34 . . . . 73.12 110.841 -179.822 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 93.82 17.93 39.48 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.709 -0.758 . . . . 74.12 112.446 179.941 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' THR . . . . . 0.583 HG21 HG22 ' A' ' 28' ' ' THR . 70.0 p -151.07 174.29 13.35 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.758 0.313 . . . . 74.04 111.146 -179.819 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.488 HD13 HD21 ' M' ' 31' ' ' LEU . 22.6 mt -104.84 110.93 32.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.279 -0.419 . . . . 75.33 111.163 179.897 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -75.12 -172.98 1.84 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.219 -0.446 . . . . 70.32 110.873 179.874 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.536 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 2.5 t80 -65.52 -58.31 12.18 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-O 121.644 0.735 . . . . 74.41 110.947 -179.916 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 66' ' ' PRO . . . . . 0.536 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 53.7 Cg_endo -69.77 -26.98 27.0 Favored 'Trans proline' 0 C--N 1.341 0.16 0 C-N-CA 122.636 2.224 . . . . 74.33 112.38 179.962 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -60.91 -41.41 96.04 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.186 -0.461 . . . . 75.35 110.879 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 8.3 t80 -74.58 -35.72 63.03 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.154 -0.476 . . . . 73.44 110.909 -179.923 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 18.6 tp -68.76 -54.13 17.82 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.113 -0.494 . . . . 73.53 110.903 -179.976 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 14.6 t -52.97 -28.18 22.55 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.183 -0.462 . . . . 73.33 111.141 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' MET . . . . . 0.44 ' SD ' HD23 ' M' ' 31' ' ' LEU . 43.2 ttp -64.92 -48.35 74.45 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.239 -0.437 . . . . 74.24 110.885 179.881 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 72' ' ' MET . . . . . 0.614 ' HE3' HG21 ' M' ' 35' ' ' VAL . 0.1 OUTLIER -63.34 -38.21 90.26 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.248 -0.433 . . . . 72.32 110.876 179.944 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.278 0 CA-C-N 116.268 -0.424 . . . . 65.21 111.098 179.929 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.41 HG21 HG22 ' A' ' 142' ' ' VAL . 78.8 mt . . . . . 0 C--O 1.231 0.1 0 CA-C-O 120.82 0.343 . . . . 75.14 111.109 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.79 -53.34 13.68 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.182 -0.463 . . . . 75.51 110.889 179.97 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 11.6 tt0 -51.9 -46.37 64.54 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.205 -0.452 . . . . 71.02 110.874 -179.942 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -56.18 -41.44 75.52 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.182 -0.463 . . . . 74.22 111.08 179.936 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 9.4 t80 -54.74 -36.47 64.82 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.256 -0.429 . . . . 71.43 110.863 -179.899 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.76 -47.09 64.25 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.114 -0.494 . . . . 70.02 110.86 -179.888 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 84.5 t -53.22 -28.6 15.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.204 -0.453 . . . . 71.15 111.13 179.974 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.49 ' CE1' HG11 ' A' ' 108' ' ' VAL . 9.4 m-85 -94.9 -28.2 15.32 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.149 -0.478 . . . . 71.54 110.852 -179.959 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 37.9 t0 -81.48 81.72 7.51 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.169 -0.469 . . . . 45.2 110.848 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 4.5 mptp? -76.46 -43.78 38.43 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.228 -0.442 . . . . 75.41 110.87 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 10.0 p30 -72.87 -9.14 58.36 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.215 -0.448 . . . . 63.22 110.837 179.888 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 60.34 30.67 71.77 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.717 -0.754 . . . . 73.43 112.489 -179.925 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 33.8 p-10 -82.35 -16.15 50.23 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.927 0.394 . . . . 32.34 110.922 -179.879 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 80.37 18.73 70.67 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.7 -0.762 . . . . 44.04 112.53 179.969 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 22.8 m-85 -143.52 142.56 31.18 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.859 0.361 . . . . 73.42 110.934 -179.827 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 68.5 mt -103.92 119.46 52.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.173 -0.467 . . . . 74.53 111.106 179.907 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 8.5 p -105.05 -175.42 2.79 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.132 -0.485 . . . . 63.34 110.865 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 102' ' ' ALA . . . . . 0.544 ' O ' HG11 ' A' ' 121' ' ' VAL . . . -74.59 -28.09 60.76 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.104 -0.498 . . . . 43.31 111.083 179.938 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -71.89 -38.34 70.01 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.229 -0.441 . . . . 72.04 111.13 179.968 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -74.06 -44.59 53.69 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.196 -0.457 . . . . 74.13 110.903 -179.963 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 23.3 tp -52.88 -33.74 51.43 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.162 -0.472 . . . . 55.32 110.923 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 106' ' ' ARG . . . . . 0.691 ' O ' HG23 ' A' ' 110' ' ' THR . 53.3 ttp85 -70.57 -44.42 67.42 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.164 -0.471 . . . . 74.22 110.905 179.914 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 2.7 t60 -54.59 -37.24 65.3 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.172 -0.467 . . . . 63.11 110.891 179.986 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.49 HG11 ' CE1' ' A' ' 92' ' ' PHE . 38.4 t -73.47 -33.18 39.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.191 -0.459 . . . . 72.12 111.123 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 109' ' ' MET . . . . . 0.542 ' HG3' HD12 ' A' ' 116' ' ' LEU . 15.4 mmt -70.38 -32.46 70.13 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.186 -0.461 . . . . 65.2 110.902 179.948 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 110' ' ' THR . . . . . 0.691 HG23 ' O ' ' A' ' 106' ' ' ARG . 20.4 p -60.47 -43.02 97.35 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.226 -0.443 . . . . 74.11 111.161 -179.961 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 29.9 m-20 -74.66 -30.18 61.51 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.251 -0.431 . . . . 73.35 110.901 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 14.9 mt -70.69 -26.04 63.25 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.175 -0.466 . . . . 71.44 110.927 179.928 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 100.74 30.9 5.94 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.71 -0.757 . . . . 43.55 112.525 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -125.04 109.97 13.59 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.931 0.396 . . . . 64.53 110.888 -179.856 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 115' ' ' LYS . . . . . 0.509 ' O ' HD23 ' A' ' 116' ' ' LEU . 7.9 ptmm? -75.28 125.97 30.06 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.168 -0.469 . . . . 74.04 110.889 179.992 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.658 HD22 ' HG2' ' A' ' 120' ' ' GLU . 36.2 mt -145.12 163.35 34.58 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.201 -0.454 . . . . 72.21 110.94 179.903 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 117' ' ' THR . . . . . 0.717 ' O ' HG23 ' A' ' 121' ' ' VAL . 23.7 p -118.73 173.7 6.71 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.219 -0.446 . . . . 72.13 111.101 179.971 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -58.01 -38.61 76.48 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.202 -0.454 . . . . 73.31 110.872 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 13.4 tt0 -71.96 -33.6 68.32 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.207 -0.451 . . . . 71.22 110.901 -179.92 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 120' ' ' GLU . . . . . 0.658 ' HG2' HD22 ' A' ' 116' ' ' LEU . 6.2 tp10 -71.1 -44.49 65.54 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.151 -0.477 . . . . 73.05 110.856 -179.951 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.717 HG23 ' O ' ' A' ' 117' ' ' THR . 39.6 t -58.93 -31.6 45.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.203 -0.453 . . . . 75.12 111.15 179.995 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -52.01 -42.3 62.92 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.172 -0.467 . . . . 64.12 110.863 179.906 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 68.4 tt0 -57.81 -31.4 66.56 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.222 -0.445 . . . . 75.52 110.908 -179.921 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 30.7 mtp -76.07 -58.76 3.09 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.101 -0.499 . . . . 53.43 110.897 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.435 HG13 ' HB2' ' A' ' 102' ' ' ALA . 35.9 mm -53.9 -35.71 28.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.215 -0.448 . . . . 73.31 111.149 179.932 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 38.8 ttt180 -63.42 -31.85 73.13 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.175 -0.466 . . . . 73.15 110.91 179.931 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 -74.58 -52.38 11.95 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.198 -0.456 . . . . 72.03 110.88 -179.94 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.675 ' HB3' HG22 ' A' ' 136' ' ' VAL . . . -65.34 -34.43 78.3 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.137 -0.483 . . . . 54.3 111.078 179.999 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 49.3 t0 -68.43 86.72 0.3 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.184 -0.462 . . . . 72.24 110.859 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 59.0 mt -79.82 -46.22 22.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.181 -0.463 . . . . 70.42 111.135 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 21.2 p30 -72.78 -8.69 56.65 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.202 -0.454 . . . . 71.13 110.869 179.845 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 62.79 42.71 99.64 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.738 -0.744 . . . . 64.31 112.46 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 34.7 p-10 -87.75 -15.9 35.71 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.867 0.365 . . . . 74.01 110.914 179.99 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 104.1 2.34 45.15 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.719 -0.753 . . . . 72.43 112.473 -179.941 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 4.2 tt0 -149.21 172.23 15.18 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.808 0.337 . . . . 64.4 110.921 -179.858 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 136' ' ' VAL . . . . . 0.675 HG22 ' HB3' ' A' ' 128' ' ' ALA . 98.7 t -106.91 109.98 30.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.185 -0.461 . . . . 61.42 111.132 179.913 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 20.2 p30 -90.99 165.12 13.71 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.159 -0.473 . . . . 55.11 110.885 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 34.2 t80 -52.16 -46.76 65.6 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.155 -0.475 . . . . 63.0 110.919 -179.912 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 19.0 tp10 -52.0 -40.15 60.54 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.15 -0.477 . . . . 74.21 110.835 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 22.9 mt-10 -78.4 -32.68 48.91 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.206 -0.452 . . . . 74.21 110.916 -179.935 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 65.5 t80 -67.8 -39.01 84.03 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.152 -0.476 . . . . 73.01 110.89 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 142' ' ' VAL . . . . . 0.41 HG22 HG21 ' A' ' 85' ' ' ILE . 95.7 t -71.25 -50.85 38.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.148 -0.478 . . . . 72.24 111.142 179.96 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 14.9 tt0 -61.32 -38.68 87.77 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.221 -0.445 . . . . 74.11 110.898 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 15.4 tpt -68.9 -55.58 10.6 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.218 -0.446 . . . . 72.32 110.862 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 12.5 ttm -60.54 -29.54 69.2 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.234 -0.439 . . . . 73.42 110.921 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 1.8 m . . . . . 0 C--N 1.33 -0.267 0 CA-C-N 116.192 -0.458 . . . . 64.45 111.143 -179.927 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' M' M ' 15' ' ' LYS . . . . . 0.433 ' HB3' ' HE3' ' A' ' 109' ' ' MET . 41.1 mttp . . . . . 0 C--O 1.23 0.078 0 CA-C-O 120.762 0.315 . . . . 71.1 110.885 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' M' M ' 16' ' ' TRP . . . . . 0.62 ' CE3' HD12 ' M' ' 19' ' ' ILE . 12.0 m95 -53.01 -40.56 63.93 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.233 -0.439 . . . . 72.45 110.912 179.96 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' M' M ' 17' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -56.35 -26.05 51.32 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.267 -0.424 . . . . 62.04 110.923 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' M' M ' 18' ' ' LYS . . . . . . . . . . . . . 29.1 tttp -78.69 -26.58 44.95 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.146 -0.479 . . . . 63.04 110.908 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' M' M ' 19' ' ' ILE . . . . . 0.62 HD12 ' CE3' ' M' ' 16' ' ' TRP . 39.3 mt -87.79 -25.18 6.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.226 -0.443 . . . . 74.55 111.1 179.88 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' M' M ' 20' ' ' ARG . . . . . . . . . . . . . 25.5 ttp180 . . . . . 0 C--N 1.329 -0.326 0 CA-C-N 116.228 -0.442 . . . . 73.44 110.864 179.962 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' M' M ' 30' ' ' LYS . . . . . . . . . . . . . 15.8 tttp . . . . . 0 C--O 1.232 0.153 0 CA-C-O 120.786 0.327 . . . . 70.21 110.859 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' M' M ' 31' ' ' LEU . . . . . 0.643 HD12 HD12 ' M' ' 34' ' ' ILE . 15.5 tp -106.77 -49.77 3.24 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.233 -0.44 . . . . 63.42 110.955 179.918 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' M' M ' 32' ' ' LYS . . . . . . . . . . . . . 39.7 tttm -48.23 -45.78 34.59 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.158 -0.473 . . . . 73.52 110.912 179.789 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' M' M ' 33' ' ' HIS . . . . . . . . . . . . . 19.8 t-160 -51.21 -39.3 56.21 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.257 -0.429 . . . . 64.11 110.88 179.881 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' M' M ' 34' ' ' ILE . . . . . 0.643 HD12 HD12 ' M' ' 31' ' ' LEU . 72.5 mt -51.18 -37.78 18.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.196 -0.456 . . . . 64.45 111.186 179.982 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' M' M ' 35' ' ' VAL . . . . . 0.614 HG21 ' HE3' ' A' ' 72' ' ' MET . 46.3 t -49.11 -39.11 12.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.157 -0.474 . . . . 64.45 111.133 179.86 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' M' M ' 36' ' ' TRP . . . . . . . . . . . . . 19.5 m0 -58.44 -40.03 81.47 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.154 -0.475 . . . . 74.25 110.892 179.967 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' M' M ' 37' ' ' ALA . . . . . 1.004 ' HB3' HD13 ' A' ' 39' ' ' LEU . . . -63.2 -18.7 63.78 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.191 -0.459 . . . . 75.31 111.097 179.931 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' M' M ' 38' ' ' SER . . . . . . . . . . . . . 1.5 m -68.24 -18.07 64.46 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.185 -0.462 . . . . 70.45 110.853 -179.727 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' M' M ' 39' ' ' ARG . . . . . . . . . . . . . 41.2 mtp180 -52.49 -29.56 25.54 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.087 -0.506 . . . . 43.23 110.862 -179.946 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' M' M ' 40' ' ' GLU . . . . . . . . . . . . . 21.7 mt-10 -82.06 -48.05 11.87 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.178 -0.465 . . . . 64.35 110.892 -179.915 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' M' M ' 41' ' ' LEU . . . . . 0.562 HD21 ' OG ' ' A' ' 38' ' ' SER . 9.8 mt . . . . . 0 C--N 1.329 -0.3 0 CA-C-N 116.184 -0.462 . . . . 72.34 110.929 179.998 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 35.0 tt0 . . . . . 0 C--O 1.232 0.143 0 CA-C-O 120.746 0.308 . . . . 63.22 110.878 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 62.1 mt -72.53 -37.68 57.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.246 -0.434 . . . . 73.24 111.143 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -56.03 -45.23 79.23 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.115 -0.493 . . . . 62.15 111.082 179.872 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -66.44 -32.2 73.42 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.2 -0.455 . . . . 64.24 110.921 -179.958 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.413 ' HB3' HD13 ' A' ' 69' ' ' LEU . 9.4 m-85 -73.44 -45.93 51.44 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.119 -0.491 . . . . 63.43 110.888 -179.95 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 34.9 ttmt -56.76 -37.61 71.29 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.172 -0.467 . . . . 63.42 110.907 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -59.92 -30.69 69.22 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.272 -0.422 . . . . 75.54 110.891 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -67.26 -42.39 83.97 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.174 -0.466 . . . . 63.22 111.119 179.933 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 40.8 t80 -58.16 -54.13 50.39 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.238 -0.437 . . . . 65.33 110.891 -179.928 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 6.8 t -52.26 -31.09 30.84 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.146 -0.479 . . . . 75.24 110.833 -179.814 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 16.2 tp -65.74 -49.34 68.78 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.187 -0.461 . . . . 71.24 110.919 179.996 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.826 ' HA ' HG21 ' A' ' 35' ' ' VAL . 33.1 m-85 -72.28 -25.97 61.8 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.178 -0.464 . . . . 75.52 110.853 179.96 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 13.5 t0 -86.05 98.53 10.9 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.163 -0.472 . . . . 64.44 110.901 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 6.7 tppt? -68.96 -52.78 25.42 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.23 -0.441 . . . . 71.34 110.869 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 24.1 p-10 -77.08 -10.08 59.15 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.241 -0.436 . . . . 75.31 110.913 179.861 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 52.11 48.4 52.77 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.773 -0.727 . . . . 64.1 112.433 -179.978 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 31.8 p-10 -88.53 -15.71 34.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.818 0.342 . . . . 74.34 110.889 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 105.41 -11.64 47.25 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.718 -0.753 . . . . 72.3 112.5 -179.925 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 4.2 p -132.13 130.7 41.5 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.712 0.292 . . . . 72.31 111.151 -179.873 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.487 HG22 ' HB2' ' A' ' 32' ' ' LEU . 23.2 mt -89.7 114.01 26.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.239 -0.437 . . . . 64.25 111.117 179.906 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.583 HG22 HG21 ' A' ' 62' ' ' THR . 44.8 p -93.38 170.67 9.44 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.216 -0.447 . . . . 74.53 111.113 179.957 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.584 HG22 HD12 ' A' ' 52' ' ' ILE . 82.4 p -58.17 -34.47 70.35 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.213 -0.449 . . . . 72.25 111.119 -179.955 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 30.8 tptt -79.84 -50.13 10.96 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.213 -0.448 . . . . 74.34 110.922 179.882 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.53 ' OE1' HG23 ' A' ' 28' ' ' THR . 60.1 mt-10 -59.03 -34.69 72.2 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.189 -0.46 . . . . 72.41 110.928 179.931 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.487 ' HB2' HG22 ' A' ' 27' ' ' ILE . 4.1 tt -74.22 -55.68 5.78 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.138 -0.483 . . . . 73.5 110.894 -179.986 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -52.3 -27.87 25.64 Favored Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.752 -0.737 . . . . 73.34 112.485 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 96.3 m -58.5 -58.06 10.2 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.838 0.352 . . . . 61.23 111.131 -179.821 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.826 HG21 ' HA ' ' A' ' 19' ' ' PHE . 98.7 t -56.21 -47.55 80.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.225 -0.443 . . . . 72.23 111.084 179.933 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 7.0 mtp -51.86 -41.36 61.8 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.201 -0.454 . . . . 72.03 110.879 179.897 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 27.9 ttt180 -53.09 -45.44 68.2 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.244 -0.435 . . . . 65.43 110.829 -179.896 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' SER . . . . . 0.655 ' OG ' HD11 ' M' ' 41' ' ' LEU . 1.8 p -61.25 -26.14 67.55 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.247 -0.433 . . . . 64.34 110.843 -179.739 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.996 HD13 ' HB3' ' M' ' 37' ' ' ALA . 18.0 mt -89.86 -16.35 30.27 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.163 -0.472 . . . . 72.45 110.889 -180.0 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 101.44 27.34 7.26 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.725 -0.75 . . . . 64.42 112.467 179.853 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 22.0 mm100 -116.88 106.5 13.52 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.78 0.324 . . . . 61.25 110.901 -179.916 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 14.6 t-20 -109.99 76.56 1.0 Allowed Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 121.637 0.732 . . . . 74.21 110.865 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.75 168.09 22.55 Favored 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.656 2.237 . . . . 72.31 112.334 179.925 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 19.0 p -87.6 156.67 19.39 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.195 -0.457 . . . . 63.13 111.162 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -51.8 -41.77 61.96 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.205 -0.452 . . . . 61.32 110.893 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.23 -32.16 64.58 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.187 -0.46 . . . . 71.44 111.098 179.901 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 68.3 tt0 -68.86 -50.08 52.83 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.222 -0.445 . . . . 64.23 110.915 -179.887 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 16.0 mt -55.12 -45.24 75.54 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.087 -0.506 . . . . 64.24 110.922 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 3.8 tm0? -71.77 -28.68 63.8 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.166 -0.47 . . . . 73.11 110.895 179.917 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -63.71 -49.76 71.82 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.231 -0.44 . . . . 74.45 110.901 179.946 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 5.5 ptp -66.2 -37.47 85.68 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.19 -0.459 . . . . 62.33 110.872 179.988 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.584 HD12 HG22 ' A' ' 29' ' ' THR . 66.0 mt -67.07 -38.1 80.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.203 -0.453 . . . . 72.41 111.059 -179.958 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 14.3 m-20 -59.58 -37.63 79.05 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.231 -0.44 . . . . 75.3 110.881 179.935 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 70.0 mm-40 -61.98 -47.95 82.52 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.196 -0.456 . . . . 61.41 110.897 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 16.9 m -77.81 -15.24 14.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.141 -0.482 . . . . 62.13 111.099 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 37.3 t0 -66.8 94.26 0.3 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.223 -0.444 . . . . 72.45 110.861 179.929 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.27 -35.92 16.99 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.182 -0.463 . . . . 53.22 111.11 179.945 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 1.9 p-10 -88.67 -0.17 57.02 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.235 -0.439 . . . . 70.14 110.867 179.996 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 54.5 60.09 9.12 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.746 -0.74 . . . . 61.11 112.5 -179.913 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 50.9 p-10 -114.6 -15.79 11.94 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.912 0.386 . . . . 72.44 110.91 -179.921 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 93.4 13.26 56.06 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.771 -0.728 . . . . 53.13 112.504 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' THR . . . . . 0.583 HG21 HG22 ' A' ' 28' ' ' THR . 70.3 p -150.65 171.93 16.36 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.732 0.301 . . . . 75.5 111.157 -179.88 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 16.1 mt -96.1 115.17 34.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.223 -0.444 . . . . 73.43 111.1 179.947 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.7 t0 -78.78 -175.26 4.35 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.18 -0.464 . . . . 61.35 110.884 179.866 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.531 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 2.5 t80 -63.5 -58.37 15.75 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.634 0.73 . . . . 72.13 110.898 -179.888 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 66' ' ' PRO . . . . . 0.531 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 53.6 Cg_endo -69.79 -30.64 21.82 Favored 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.624 2.216 . . . . 74.24 112.343 -179.994 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 55.8 mt-10 -59.0 -40.77 85.91 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.268 -0.424 . . . . 71.33 110.909 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 12.7 t80 -74.17 -35.68 64.02 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.171 -0.468 . . . . 73.41 110.911 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.413 HD13 ' HB3' ' A' ' 12' ' ' PHE . 27.6 tp -68.4 -53.88 20.86 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.141 -0.482 . . . . 43.21 110.937 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 15.3 t -53.63 -29.17 36.88 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.184 -0.462 . . . . 61.12 111.133 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' MET . . . . . 0.495 ' HE3' HD11 ' M' ' 31' ' ' LEU . 35.4 ttp -62.78 -43.49 98.66 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.237 -0.438 . . . . 70.4 110.856 179.964 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 72' ' ' MET . . . . . 0.585 ' HE3' HG11 ' M' ' 35' ' ' VAL . 3.3 mmt -71.4 -29.72 65.25 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.236 -0.438 . . . . 71.31 110.9 179.927 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.309 0 CA-C-N 116.226 -0.443 . . . . 62.51 111.136 179.915 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.458 HG21 ' HA ' ' A' ' 142' ' ' VAL . 70.6 mt . . . . . 0 C--O 1.232 0.142 0 CA-C-O 120.813 0.34 . . . . 75.44 111.181 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 45.7 ttp180 -62.5 -28.32 69.75 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.176 -0.465 . . . . 64.12 110.924 179.924 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.73 ' O ' HG23 ' A' ' 91' ' ' VAL . 10.0 mm-40 -76.13 -46.87 26.63 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.207 -0.451 . . . . 73.51 110.922 179.983 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 88' ' ' ALA . . . . . 0.628 ' HB1' ' CE2' ' A' ' 92' ' ' PHE . . . -63.75 -42.68 97.8 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.171 -0.468 . . . . 74.25 111.1 179.924 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 9.9 t80 -52.02 -50.69 60.9 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.211 -0.45 . . . . 74.32 110.88 -179.905 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 32.1 ttm180 -62.75 -35.98 81.56 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.141 -0.481 . . . . 73.23 110.858 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 91' ' ' VAL . . . . . 0.73 HG23 ' O ' ' A' ' 87' ' ' GLU . 85.3 t -63.91 -42.67 96.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.186 -0.461 . . . . 73.11 111.134 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.628 ' CE2' ' HB1' ' A' ' 88' ' ' ALA . 9.2 m-85 -78.2 -31.18 49.31 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.157 -0.474 . . . . 75.44 110.899 -179.983 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 22.7 t0 -61.25 96.91 0.06 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.168 -0.469 . . . . 75.45 110.894 179.98 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 13.4 mmmt -77.35 -53.34 7.8 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.23 -0.441 . . . . 61.14 110.872 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 16.5 p30 -74.25 -9.19 58.36 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.226 -0.443 . . . . 64.55 110.838 179.902 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 59.69 25.86 61.78 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.75 -0.738 . . . . 54.1 112.465 -179.917 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 40.5 p-10 -82.11 -16.16 50.91 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.824 0.345 . . . . 73.45 110.901 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 86.7 18.7 57.93 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.735 -0.745 . . . . 73.22 112.485 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 13.0 m-85 -137.85 134.27 34.9 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.888 0.375 . . . . 73.11 110.933 -179.816 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 71.4 mt -100.04 125.6 53.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.098 -0.501 . . . . 51.52 111.102 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 86.0 p -109.17 -172.81 2.12 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.198 -0.455 . . . . 63.14 110.885 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 102' ' ' ALA . . . . . 0.517 ' HB1' ' CG1' ' A' ' 121' ' ' VAL . . . -72.74 -37.11 67.81 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.114 -0.494 . . . . 52.44 111.074 179.883 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -70.24 -49.92 45.1 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.238 -0.437 . . . . 51.2 111.101 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -62.56 -48.5 79.19 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.227 -0.442 . . . . 75.43 110.867 -179.911 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.44 HD11 ' CD1' ' M' ' 19' ' ' ILE . 30.4 tp -56.35 -26.85 54.06 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.169 -0.468 . . . . 74.4 110.904 -179.933 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 106' ' ' ARG . . . . . 0.451 ' O ' HG23 ' A' ' 110' ' ' THR . 17.9 ttm180 -73.35 -29.04 62.39 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.175 -0.466 . . . . 63.22 110.875 179.938 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 19.8 t60 -66.95 -34.69 78.32 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.191 -0.459 . . . . 73.1 110.871 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 40.9 t -74.49 -39.58 47.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.17 -0.468 . . . . 72.32 111.168 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 2.3 mmt -73.87 -38.69 64.34 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.164 -0.471 . . . . 61.55 110.913 179.857 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 110' ' ' THR . . . . . 0.451 HG23 ' O ' ' A' ' 106' ' ' ARG . 3.0 p -54.12 -32.75 56.0 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.209 -0.45 . . . . 74.43 111.165 -179.935 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -74.68 -28.35 60.79 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.218 -0.446 . . . . 74.02 110.887 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -70.68 -25.95 63.21 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.19 -0.459 . . . . 74.13 110.933 179.947 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 100.84 19.4 17.51 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.73 -0.748 . . . . 52.43 112.518 179.93 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -102.81 127.9 49.79 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.873 0.368 . . . . 73.4 110.896 -179.874 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 34.0 mttp -80.83 117.51 21.55 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.186 -0.461 . . . . 73.32 110.929 179.945 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 15.3 mt -130.02 113.34 14.44 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.253 -0.43 . . . . 75.03 110.909 179.933 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 117' ' ' THR . . . . . 0.588 ' O ' HG23 ' A' ' 121' ' ' VAL . 75.1 p -81.91 171.22 14.71 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.17 -0.468 . . . . 71.12 111.156 179.932 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 46.7 m-20 -52.01 -36.68 50.78 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.238 -0.437 . . . . 74.04 110.826 179.9 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -75.23 -33.4 61.35 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.163 -0.471 . . . . 73.11 110.928 -179.91 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -69.63 -42.19 74.62 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.111 -0.495 . . . . 64.14 110.906 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.588 HG23 ' O ' ' A' ' 117' ' ' THR . 21.8 t -61.03 -38.62 79.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.163 -0.471 . . . . 72.12 111.119 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 50.0 t0 -56.88 -45.48 82.49 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.212 -0.449 . . . . 65.51 110.9 179.901 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 15.5 tm-20 -57.51 -34.26 68.91 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.193 -0.458 . . . . 73.32 110.839 -179.924 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 124' ' ' MET . . . . . 0.406 ' HE2' ' HG3' ' M' ' 15' ' ' LYS . 27.1 mtp -70.69 -59.56 2.75 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.2 -0.454 . . . . 62.33 110.862 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.45 HG13 ' HB2' ' A' ' 102' ' ' ALA . 36.3 mm -53.97 -35.5 28.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.211 -0.449 . . . . 74.31 111.134 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 56.5 ttt85 -63.07 -31.84 73.08 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.171 -0.468 . . . . 75.55 110.863 179.986 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -75.11 -52.38 11.14 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.148 -0.478 . . . . 64.02 110.9 -179.959 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.659 ' HB3' HG22 ' A' ' 136' ' ' VAL . . . -64.88 -34.41 78.32 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.168 -0.469 . . . . 73.25 111.126 179.909 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 49.0 t0 -68.37 86.9 0.29 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.197 -0.456 . . . . 74.1 110.853 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 64.7 mt -79.85 -46.61 22.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.178 -0.465 . . . . 74.12 111.145 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 21.5 p30 -72.63 -8.69 56.53 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.175 -0.466 . . . . 74.52 110.865 179.848 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 62.86 43.02 99.54 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.73 -0.748 . . . . 44.32 112.497 -179.944 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 34.5 p-10 -88.51 -15.91 34.05 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.865 0.364 . . . . 52.02 110.869 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 104.14 2.35 45.03 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.768 -0.729 . . . . 64.15 112.468 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 5.3 tt0 -149.21 172.29 15.08 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.814 0.34 . . . . 61.22 110.913 -179.902 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 136' ' ' VAL . . . . . 0.659 HG22 ' HB3' ' A' ' 128' ' ' ALA . 72.4 t -106.83 109.28 27.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.185 -0.462 . . . . 62.22 111.111 179.977 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 20.9 p30 -91.27 164.79 13.75 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.159 -0.473 . . . . 50.24 110.859 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 138' ' ' TYR . . . . . 0.583 ' O ' HG23 ' A' ' 142' ' ' VAL . 37.5 t80 -52.25 -46.22 65.68 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.185 -0.462 . . . . 65.41 110.923 -179.97 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -51.91 -39.74 59.58 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.117 -0.492 . . . . 72.24 110.868 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 26.1 mt-10 -78.38 -37.36 44.32 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.172 -0.467 . . . . 52.53 110.887 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 36.8 t80 -63.95 -39.61 94.55 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.135 -0.484 . . . . 64.41 110.855 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 142' ' ' VAL . . . . . 0.583 HG23 ' O ' ' A' ' 138' ' ' TYR . 90.9 t -63.74 -50.72 76.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.175 -0.466 . . . . 61.0 111.119 -179.996 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 143' ' ' GLN . . . . . 0.548 ' HA ' HG22 ' A' ' 146' ' ' THR . 43.3 tt0 -70.8 -23.38 62.36 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.181 -0.463 . . . . 73.23 110.927 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 11.7 tpt -75.03 -18.73 60.29 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.157 -0.474 . . . . 72.2 110.904 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 145' ' ' MET . . . . . 0.499 ' HE2' ' HA ' ' M' ' 20' ' ' ARG . 5.8 ttm -98.2 -32.98 11.3 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.225 -0.443 . . . . 72.02 110.856 179.954 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 146' ' ' THR . . . . . 0.548 HG22 ' HA ' ' A' ' 143' ' ' GLN . 5.0 t . . . . . 0 C--N 1.329 -0.291 0 CA-C-N 116.256 -0.429 . . . . 35.21 111.128 -179.918 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' M' M ' 15' ' ' LYS . . . . . 0.406 ' HG3' ' HE2' ' A' ' 124' ' ' MET . 0.4 OUTLIER . . . . . 0 C--O 1.231 0.083 0 CA-C-O 120.815 0.341 . . . . 74.22 110.939 . . . . . . . . . 2 2 . 1 . 006 nuclear build core ' M' M ' 16' ' ' TRP . . . . . 0.581 ' CZ3' HD12 ' M' ' 19' ' ' ILE . 3.1 m95 -51.94 -38.59 57.04 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.222 -0.445 . . . . 72.54 110.865 179.908 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' M' M ' 17' ' ' GLU . . . . . . . . . . . . . 58.4 tt0 -56.07 -30.91 62.68 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.251 -0.431 . . . . 73.21 110.944 -179.959 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' M' M ' 18' ' ' LYS . . . . . . . . . . . . . 6.5 tppt? -52.02 -30.41 25.28 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.13 -0.486 . . . . 72.52 110.892 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' M' M ' 19' ' ' ILE . . . . . 0.581 HD12 ' CZ3' ' M' ' 16' ' ' TRP . 64.1 mt -91.31 -24.54 5.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.167 -0.47 . . . . 74.2 111.088 179.901 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' M' M ' 20' ' ' ARG . . . . . 0.499 ' HA ' ' HE2' ' A' ' 145' ' ' MET . 12.1 ttm180 . . . . . 0 C--N 1.329 -0.288 0 CA-C-N 116.204 -0.453 . . . . 72.1 110.835 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' M' M ' 30' ' ' LYS . . . . . . . . . . . . . 14.5 mtmm . . . . . 0 C--O 1.231 0.129 0 CA-C-O 120.817 0.341 . . . . 73.31 110.889 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' M' M ' 31' ' ' LEU . . . . . 0.495 HD11 ' HE3' ' A' ' 71' ' ' MET . 0.8 OUTLIER -96.99 -28.05 14.34 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.247 -0.433 . . . . 72.35 110.909 179.927 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' M' M ' 32' ' ' LYS . . . . . . . . . . . . . 7.5 tttp -49.2 -46.42 45.67 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.205 -0.452 . . . . 65.45 110.889 179.825 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' M' M ' 33' ' ' HIS . . . . . . . . . . . . . 22.1 t-160 -50.95 -37.18 42.87 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.239 -0.437 . . . . 72.24 110.842 179.91 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' M' M ' 34' ' ' ILE . . . . . . . . . . . . . 47.6 mm -50.33 -39.57 17.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.221 -0.445 . . . . 75.0 111.157 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' M' M ' 35' ' ' VAL . . . . . 0.585 HG11 ' HE3' ' A' ' 72' ' ' MET . 46.9 t -48.86 -40.18 12.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.131 -0.486 . . . . 72.14 111.132 179.818 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' M' M ' 36' ' ' TRP . . . . . . . . . . . . . 23.6 m0 -58.62 -39.91 81.82 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.177 -0.465 . . . . 74.32 110.956 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' M' M ' 37' ' ' ALA . . . . . 0.996 ' HB3' HD13 ' A' ' 39' ' ' LEU . . . -63.69 -18.66 64.21 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.198 -0.455 . . . . 73.23 111.141 179.845 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' M' M ' 38' ' ' SER . . . . . . . . . . . . . 13.2 m -69.48 -17.95 63.66 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.199 -0.455 . . . . 65.1 110.876 -179.811 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' M' M ' 39' ' ' ARG . . . . . . . . . . . . . 25.8 mmm180 -63.11 -24.18 67.78 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.122 -0.49 . . . . 73.43 110.831 -179.916 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' M' M ' 40' ' ' GLU . . . . . . . . . . . . . 17.3 tt0 -80.72 -48.07 13.07 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.212 -0.449 . . . . 73.4 110.905 -179.946 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' M' M ' 41' ' ' LEU . . . . . 0.655 HD11 ' OG ' ' A' ' 38' ' ' SER . 19.7 mt . . . . . 0 C--N 1.328 -0.336 0 CA-C-N 116.168 -0.469 . . . . 74.3 110.913 -179.992 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 28.5 tp60 . . . . . 0 C--O 1.231 0.112 0 CA-C-O 120.787 0.327 . . . . 73.12 110.915 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 54.3 mt -69.16 -37.25 76.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.205 -0.452 . . . . 60.52 111.114 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -51.95 -39.06 58.65 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.161 -0.472 . . . . 73.34 111.12 179.796 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 56.8 mt-10 -72.64 -52.03 17.06 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.234 -0.439 . . . . 73.42 110.89 -179.917 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.531 ' HB3' HD13 ' A' ' 69' ' ' LEU . 30.4 m-85 -55.96 -39.6 71.99 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.151 -0.477 . . . . 74.32 110.861 -179.913 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.14 -31.35 65.25 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.109 -0.496 . . . . 43.13 110.883 -179.985 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 24.4 tt0 -72.27 -30.71 65.11 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.231 -0.44 . . . . 63.32 110.879 179.966 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -72.77 -35.04 67.35 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.162 -0.472 . . . . 65.23 111.115 179.92 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 91.5 t80 -75.63 -51.99 11.58 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.213 -0.449 . . . . 73.32 110.87 -179.874 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 14.8 t -52.03 -31.79 31.42 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.158 -0.474 . . . . 75.45 110.845 -179.79 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.533 HD23 ' HB3' ' M' ' 38' ' ' SER . 15.9 tp -64.05 -47.11 81.46 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.071 -0.513 . . . . 65.02 110.911 -179.954 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.566 ' CD1' HG11 ' A' ' 35' ' ' VAL . 17.2 m-85 -69.79 -24.82 63.55 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.183 -0.462 . . . . 73.4 110.848 179.972 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 21.2 t0 -86.59 98.58 11.17 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.184 -0.462 . . . . 71.04 110.812 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.763 ' HE2' HG22 ' A' ' 35' ' ' VAL . 5.0 mptp? -71.23 -55.51 7.95 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.166 -0.47 . . . . 62.23 110.85 -179.99 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 23.1 p-10 -71.12 -10.25 59.43 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.249 -0.432 . . . . 71.51 110.833 179.892 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 51.49 40.6 47.21 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.746 -0.74 . . . . 54.22 112.522 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 21.1 p-10 -88.31 -15.7 35.04 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.878 0.37 . . . . 74.32 110.909 -179.977 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 104.64 -11.69 50.17 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.72 -0.752 . . . . 73.23 112.518 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 5.0 p -129.05 130.67 46.86 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.739 0.305 . . . . 44.52 111.182 -179.896 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 24.8 mt -96.83 128.64 47.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.244 -0.434 . . . . 74.51 111.149 179.933 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 32.2 p -108.31 -177.5 3.34 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.159 -0.473 . . . . 73.51 111.187 179.945 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.41 ' HB ' HD13 ' A' ' 48' ' ' LEU . 39.2 p -64.6 -37.32 87.15 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.259 -0.428 . . . . 73.35 111.141 -179.958 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 6.0 mmmm -71.99 -49.92 33.12 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.176 -0.466 . . . . 63.13 110.894 179.891 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 68.8 mt-10 -60.47 -36.61 78.67 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.212 -0.449 . . . . 75.44 110.879 179.985 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.2 tt -74.28 -55.63 5.81 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.131 -0.486 . . . . 75.34 110.931 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -52.08 -28.03 24.4 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.76 -0.734 . . . . 24.1 112.479 179.878 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 95.8 m -65.76 -54.51 26.14 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.767 0.318 . . . . 60.14 111.146 -179.889 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.763 HG22 ' HE2' ' A' ' 21' ' ' LYS . 42.7 t -55.98 -50.22 70.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.275 -0.421 . . . . 71.55 111.107 179.926 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -51.99 -38.06 55.37 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.177 -0.465 . . . . 64.12 110.853 179.915 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 32.7 ttm-85 -53.5 -52.89 58.12 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.277 -0.42 . . . . 74.44 110.872 -179.903 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' SER . . . . . 0.59 ' OG ' HD21 ' M' ' 41' ' ' LEU . 3.1 t -64.76 -26.56 68.41 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.199 -0.455 . . . . 54.2 110.864 -179.826 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.98 HD13 ' HB3' ' M' ' 37' ' ' ALA . 61.9 mt -79.45 -18.6 51.78 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.152 -0.477 . . . . 72.03 110.958 -179.994 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 101.45 28.24 6.83 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.746 -0.74 . . . . 53.53 112.458 179.88 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 48.4 mm-40 -125.09 129.88 51.12 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.819 0.342 . . . . 60.11 110.908 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 39.2 t30 -109.86 80.02 1.61 Allowed Pre-proline 0 C--N 1.33 -0.28 0 CA-C-O 121.602 0.715 . . . . 72.32 110.896 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.7 147.94 64.37 Favored 'Trans proline' 0 C--O 1.231 0.174 0 C-N-CA 122.724 2.283 . . . . 75.0 112.346 179.913 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 21.3 p -96.01 162.56 13.5 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.209 -0.45 . . . . 72.54 111.189 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 20.7 tt0 -55.28 -44.39 75.61 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.26 -0.427 . . . . 74.43 110.846 -179.951 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.25 -31.73 64.28 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.186 -0.461 . . . . 53.04 111.094 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 78.4 tt0 -66.46 -49.29 67.16 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.246 -0.434 . . . . 75.1 110.92 -179.95 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.41 HD13 ' HB ' ' A' ' 29' ' ' THR . 14.8 mt -55.15 -51.68 65.7 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.158 -0.474 . . . . 70.02 110.95 -179.991 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 15.9 tp60 -55.01 -28.93 55.84 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.196 -0.456 . . . . 65.44 110.933 179.92 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -72.89 -40.05 65.9 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.182 -0.463 . . . . 73.22 110.825 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 38.2 mtp -76.36 -25.26 54.46 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.206 -0.452 . . . . 61.54 110.868 -179.995 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 80.3 mt -79.67 -40.64 21.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.259 -0.428 . . . . 72.42 111.14 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 49.2 m-20 -60.16 -48.8 80.21 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.178 -0.464 . . . . 62.01 110.905 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 18.0 pt-20 -55.7 -27.07 48.36 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.121 -0.49 . . . . 62.4 110.911 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.584 HG11 HD23 ' M' ' 31' ' ' LEU . 32.4 m -108.34 11.71 8.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.151 -0.477 . . . . 63.1 111.166 179.955 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 26.9 t0 -90.03 98.13 11.59 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.149 -0.478 . . . . 45.42 110.863 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.28 -46.25 9.37 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.206 -0.452 . . . . 63.02 111.13 179.931 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 10.2 p-10 -81.66 -0.19 41.49 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.196 -0.456 . . . . 75.02 110.863 179.96 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 53.65 56.5 19.93 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.718 -0.753 . . . . 53.23 112.508 -179.928 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 49.6 p-10 -114.51 -15.82 11.98 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.845 0.355 . . . . 73.43 110.861 -179.857 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 91.93 17.41 47.9 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.755 -0.736 . . . . 72.34 112.477 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 20.4 p -145.54 168.37 20.76 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.793 0.33 . . . . 73.43 111.11 -179.876 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 16.9 mt -106.72 109.49 28.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.163 -0.471 . . . . 60.11 111.133 179.927 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -76.9 -172.97 2.5 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.167 -0.469 . . . . 70.34 110.852 179.864 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.535 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 2.5 t80 -65.58 -58.43 11.77 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-O 121.667 0.746 . . . . 73.15 110.92 -179.936 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 66' ' ' PRO . . . . . 0.535 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 54.2 Cg_endo -69.75 -24.98 29.11 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.658 2.239 . . . . 73.12 112.365 179.949 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 22.7 mt-10 -63.66 -40.67 97.41 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.237 -0.438 . . . . 63.5 110.914 -179.996 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 34.3 t80 -74.02 -36.28 64.45 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.161 -0.472 . . . . 64.31 110.883 -179.945 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.531 HD13 ' HB3' ' A' ' 12' ' ' PHE . 50.1 tp -70.64 -53.9 14.03 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.171 -0.468 . . . . 72.02 110.949 179.981 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 13.1 t -55.64 -26.55 45.01 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.178 -0.465 . . . . 73.55 111.126 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 9.1 tmm? -62.83 -39.61 94.84 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.197 -0.456 . . . . 64.12 110.892 179.913 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -79.76 -40.02 29.7 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.22 -0.445 . . . . 72.31 110.938 179.918 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.287 0 CA-C-N 116.184 -0.462 . . . . 74.24 111.085 179.9 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.753 HG21 HG22 ' A' ' 142' ' ' VAL . 3.1 mp . . . . . 0 C--O 1.231 0.094 0 CA-C-O 120.861 0.362 . . . . 70.31 111.148 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 41.8 ttm-85 -54.69 -28.15 45.58 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.151 -0.477 . . . . 74.01 110.885 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.726 ' O ' HG23 ' A' ' 91' ' ' VAL . 7.9 tm-20 -74.94 -58.52 3.23 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.177 -0.465 . . . . 71.4 110.866 -179.948 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 88' ' ' ALA . . . . . 0.74 ' HB1' ' CE2' ' A' ' 92' ' ' PHE . . . -58.83 -43.31 90.63 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.177 -0.465 . . . . 64.23 111.129 179.922 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 4.1 t80 -52.01 -48.11 64.63 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.166 -0.47 . . . . 64.54 110.925 -179.947 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.22 -26.19 64.68 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.13 -0.486 . . . . 72.3 110.905 -179.95 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 91' ' ' VAL . . . . . 0.726 HG23 ' O ' ' A' ' 87' ' ' GLU . 93.0 t -77.36 -27.31 15.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.16 -0.473 . . . . 61.22 111.133 179.974 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.74 ' CE2' ' HB1' ' A' ' 88' ' ' ALA . 18.2 m-85 -94.77 -28.48 15.25 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.174 -0.466 . . . . 75.54 110.872 -179.946 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 34.6 t0 -66.9 95.86 0.39 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.12 -0.491 . . . . 74.52 110.888 179.981 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 71.1 mmtt -78.73 -52.26 8.63 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.201 -0.454 . . . . 55.14 110.899 179.997 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 10.2 p30 -72.32 -9.2 58.18 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.193 -0.458 . . . . 74.3 110.838 179.886 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 59.19 26.22 61.07 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.733 -0.746 . . . . 72.2 112.518 -179.923 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 35.7 p-10 -81.75 -16.16 51.99 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.91 0.386 . . . . 74.34 110.895 -179.878 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 87.05 18.71 57.34 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.742 -0.742 . . . . 70.4 112.506 -179.968 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 19.7 m-85 -141.96 146.55 35.76 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.834 0.349 . . . . 72.21 110.948 -179.791 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.556 HD12 ' CD2' ' A' ' 141' ' ' PHE . 62.1 mt -112.89 127.47 70.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.108 -0.496 . . . . 74.03 111.178 179.87 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 96.3 p -112.75 -172.59 2.08 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.163 -0.471 . . . . 73.44 110.835 -179.876 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 102' ' ' ALA . . . . . 0.472 ' O ' HG11 ' A' ' 121' ' ' VAL . . . -65.4 -34.14 77.61 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.129 -0.487 . . . . 70.31 111.095 179.914 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -70.4 -49.89 44.27 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.213 -0.449 . . . . 53.44 111.064 179.934 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 104' ' ' GLU . . . . . 0.53 ' O ' HG23 ' A' ' 108' ' ' VAL . 21.5 mt-10 -62.24 -50.21 72.67 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.243 -0.435 . . . . 73.12 110.853 -179.875 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.456 HD21 ' HB3' ' A' ' 124' ' ' MET . 12.0 tp -53.6 -52.46 59.73 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.151 -0.477 . . . . 62.24 110.946 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 106' ' ' ARG . . . . . 0.489 ' HB2' HG21 ' A' ' 121' ' ' VAL . 31.9 ttp180 -57.34 -42.29 81.69 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.158 -0.474 . . . . 64.23 110.855 179.949 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 50.3 t60 -60.34 -34.42 73.81 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.249 -0.432 . . . . 62.32 110.903 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.53 HG23 ' O ' ' A' ' 104' ' ' GLU . 95.8 t -71.53 -52.47 25.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.188 -0.46 . . . . 61.14 111.087 179.996 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 109' ' ' MET . . . . . 0.688 ' HE3' ' HB3' ' M' ' 15' ' ' LYS . 5.6 tpp -62.69 -42.03 99.42 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.174 -0.467 . . . . 63.34 110.882 179.929 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 110' ' ' THR . . . . . 0.452 HG23 ' O ' ' A' ' 106' ' ' ARG . 12.8 p -53.84 -36.62 62.77 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.255 -0.429 . . . . 63.12 111.138 -179.933 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 87.9 m-20 -61.13 -30.24 70.25 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.248 -0.433 . . . . 64.13 110.893 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.745 HD13 ' HD3' ' M' ' 18' ' ' LYS . 23.5 mt -70.75 -23.38 62.42 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.168 -0.469 . . . . 72.44 110.914 179.988 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 101.02 32.98 5.12 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.77 -0.729 . . . . 54.5 112.509 179.901 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 34.9 tp10 -111.65 111.02 21.72 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.934 0.397 . . . . 71.41 110.922 -179.905 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 5.8 ptpp? -60.67 127.79 33.41 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.116 -0.493 . . . . 71.42 110.845 -179.985 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.468 HD21 ' HD3' ' M' ' 15' ' ' LYS . 30.5 mt -146.75 162.5 38.42 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.235 -0.438 . . . . 74.01 110.928 179.895 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 33.1 p -118.68 159.87 22.87 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.167 -0.47 . . . . 74.54 111.177 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -52.24 -39.58 60.49 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.217 -0.447 . . . . 71.34 110.857 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -72.48 -33.37 66.94 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.187 -0.46 . . . . 70.33 110.877 -179.893 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 65.4 tt0 -66.34 -39.21 89.05 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.15 -0.477 . . . . 71.33 110.888 -179.944 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.489 HG21 ' HB2' ' A' ' 106' ' ' ARG . 89.4 t -62.62 -34.24 64.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.158 -0.474 . . . . 73.31 111.133 179.982 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -51.97 -45.34 64.4 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.205 -0.452 . . . . 70.04 110.854 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 17.9 tp10 -56.62 -29.34 62.08 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.21 -0.45 . . . . 74.25 110.893 -179.915 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 124' ' ' MET . . . . . 0.474 ' HE1' ' HB2' ' M' ' 15' ' ' LYS . 8.7 mtp -74.46 -56.98 4.24 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.178 -0.464 . . . . 73.32 110.923 179.971 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 34.7 mm -54.05 -35.57 29.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.23 -0.441 . . . . 75.11 111.097 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 16.3 tpt180 -65.85 -31.75 72.88 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.203 -0.453 . . . . 73.4 110.869 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -71.33 -48.82 48.0 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.196 -0.456 . . . . 74.04 110.903 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.646 ' HB3' HG22 ' A' ' 136' ' ' VAL . . . -71.75 -34.2 69.31 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.165 -0.47 . . . . 63.25 111.089 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 49.8 t0 -68.27 86.79 0.28 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.228 -0.442 . . . . 71.43 110.887 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 56.5 mt -79.94 -46.0 22.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.204 -0.453 . . . . 71.13 111.124 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 21.7 p30 -72.7 -8.73 56.8 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.17 -0.468 . . . . 63.51 110.906 179.822 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 62.84 43.38 99.02 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.725 -0.75 . . . . 63.51 112.499 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 34.5 p-10 -88.69 -16.01 33.41 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.818 0.342 . . . . 75.34 110.841 -179.941 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 103.87 2.45 45.96 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.759 -0.734 . . . . 43.52 112.476 -179.928 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 4.5 tt0 -149.2 172.26 15.13 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.82 0.343 . . . . 74.21 110.941 -179.913 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 136' ' ' VAL . . . . . 0.646 HG22 ' HB3' ' A' ' 128' ' ' ALA . 94.4 t -108.21 111.82 37.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.204 -0.453 . . . . 72.23 111.082 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 15.5 p30 -91.85 179.63 5.56 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.155 -0.475 . . . . 74.11 110.917 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 138' ' ' TYR . . . . . 0.694 ' O ' HG23 ' A' ' 142' ' ' VAL . 36.1 t80 -63.97 -47.65 79.57 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.194 -0.457 . . . . 75.12 110.927 -179.943 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 14.3 tt0 -52.04 -39.86 60.21 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.139 -0.482 . . . . 62.24 110.867 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -78.49 -42.46 29.62 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.221 -0.445 . . . . 63.45 110.898 -179.946 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 141' ' ' PHE . . . . . 0.556 ' CD2' HD12 ' A' ' 100' ' ' ILE . 24.4 t80 -58.93 -36.7 75.2 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.15 -0.477 . . . . 72.44 110.859 -179.959 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 142' ' ' VAL . . . . . 0.753 HG22 HG21 ' A' ' 85' ' ' ILE . 94.0 t -66.66 -44.85 89.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.184 -0.462 . . . . 70.1 111.119 179.995 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 31.1 tt0 -66.54 -42.94 86.41 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.207 -0.451 . . . . 75.32 110.91 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 33.6 tpp -65.11 -26.75 68.34 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.216 -0.447 . . . . 73.23 110.868 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 145' ' ' MET . . . . . 0.407 ' HE1' HG22 ' M' ' 19' ' ' ILE . 0.0 OUTLIER -84.37 -28.16 27.17 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.232 -0.44 . . . . 60.32 110.832 179.973 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 1.6 m . . . . . 0 C--N 1.33 -0.276 0 CA-C-N 116.275 -0.42 . . . . 72.11 111.092 -179.886 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' M' M ' 15' ' ' LYS . . . . . 0.688 ' HB3' ' HE3' ' A' ' 109' ' ' MET . 11.3 mttm . . . . . 0 N--CA 1.457 -0.08 0 CA-C-O 120.744 0.307 . . . . 75.52 110.871 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' M' M ' 16' ' ' TRP . . . . . 0.727 ' CE3' HD12 ' M' ' 19' ' ' ILE . 5.6 m95 -52.27 -42.97 64.15 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.231 -0.441 . . . . 75.32 110.909 179.921 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' M' M ' 17' ' ' GLU . . . . . . . . . . . . . 48.3 tt0 -58.37 -28.08 64.8 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.224 -0.443 . . . . 61.51 110.902 -179.942 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' M' M ' 18' ' ' LYS . . . . . 0.745 ' HD3' HD13 ' A' ' 112' ' ' LEU . 14.2 ttmm -68.36 -25.85 65.29 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.146 -0.479 . . . . 53.41 110.892 179.948 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' M' M ' 19' ' ' ILE . . . . . 0.727 HD12 ' CE3' ' M' ' 16' ' ' TRP . 33.5 mt -86.46 -13.2 10.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.23 -0.441 . . . . 64.31 111.131 179.865 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' M' M ' 20' ' ' ARG . . . . . . . . . . . . . 39.7 ttp180 . . . . . 0 C--N 1.328 -0.335 0 CA-C-N 116.178 -0.465 . . . . 70.22 110.897 179.926 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' M' M ' 30' ' ' LYS . . . . . . . . . . . . . 17.4 tttm . . . . . 0 C--O 1.232 0.137 0 CA-C-O 120.762 0.315 . . . . 73.54 110.862 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' M' M ' 31' ' ' LEU . . . . . 0.584 HD23 HG11 ' A' ' 55' ' ' VAL . 10.1 tp -144.94 -52.16 0.28 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.256 -0.429 . . . . 62.42 110.934 179.941 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' M' M ' 32' ' ' LYS . . . . . . . . . . . . . 3.2 ptmm? -49.53 -36.18 22.63 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.188 -0.46 . . . . 75.52 110.9 179.824 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' M' M ' 33' ' ' HIS . . . . . . . . . . . . . 12.7 t-160 -49.74 -42.61 46.66 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.201 -0.454 . . . . 73.4 110.861 179.898 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' M' M ' 34' ' ' ILE . . . . . . . . . . . . . 55.1 mt -50.69 -38.69 17.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.201 -0.454 . . . . 73.41 111.145 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' M' M ' 35' ' ' VAL . . . . . . . . . . . . . 39.9 t -49.6 -39.54 14.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.139 -0.482 . . . . 75.12 111.166 179.859 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' M' M ' 36' ' ' TRP . . . . . . . . . . . . . 21.9 m0 -58.94 -39.29 81.18 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.196 -0.456 . . . . 71.24 110.926 179.966 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' M' M ' 37' ' ' ALA . . . . . 0.98 ' HB3' HD13 ' A' ' 39' ' ' LEU . . . -63.82 -18.64 64.33 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.226 -0.443 . . . . 52.02 111.091 179.88 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' M' M ' 38' ' ' SER . . . . . 0.533 ' HB3' HD23 ' A' ' 18' ' ' LEU . 0.9 OUTLIER -71.88 -17.96 62.08 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.193 -0.458 . . . . 75.42 110.843 -179.787 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' M' M ' 39' ' ' ARG . . . . . . . . . . . . . 60.1 mtt180 -56.48 -25.83 52.32 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.201 -0.454 . . . . 74.11 110.894 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' M' M ' 40' ' ' GLU . . . . . . . . . . . . . 22.7 tt0 -87.43 -47.99 8.33 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.205 -0.452 . . . . 75.2 110.905 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' M' M ' 41' ' ' LEU . . . . . 0.59 HD21 ' OG ' ' A' ' 38' ' ' SER . 11.7 mt . . . . . 0 C--N 1.328 -0.364 0 CA-C-N 116.179 -0.464 . . . . 73.02 110.957 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 7.0 tp60 . . . . . 0 C--O 1.232 0.135 0 CA-C-O 120.804 0.335 . . . . 74.03 110.898 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 78.3 mt -69.35 -40.61 80.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.195 -0.457 . . . . 63.32 111.147 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -53.21 -31.4 42.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.133 -0.485 . . . . 63.54 111.105 179.787 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -74.12 -39.36 63.4 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.225 -0.443 . . . . 73.12 110.913 -179.924 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 24.7 m-85 -72.25 -45.89 58.28 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.189 -0.459 . . . . 72.24 110.918 -179.954 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 24.2 ttpp -67.45 -26.75 66.55 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.148 -0.478 . . . . 71.24 110.88 179.958 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -67.02 -38.64 86.29 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.256 -0.429 . . . . 75.12 110.866 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -64.01 -34.06 77.15 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.122 -0.49 . . . . 73.03 111.121 179.887 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 51.7 t80 -57.3 -53.87 53.18 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.224 -0.444 . . . . 65.2 110.832 -179.895 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.7 t -52.6 -29.66 27.08 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.175 -0.466 . . . . 54.53 110.843 -179.785 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 15.6 tp -67.12 -48.17 68.9 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.141 -0.481 . . . . 61.14 110.91 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 44.5 m-85 -71.78 -25.34 61.98 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.227 -0.442 . . . . 75.32 110.886 179.922 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 8.1 t0 -82.54 98.56 9.02 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.139 -0.482 . . . . 73.13 110.903 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.637 ' HE3' HG21 ' A' ' 34' ' ' THR . 21.7 ttmm -69.21 -53.46 19.84 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.206 -0.452 . . . . 61.34 110.888 179.999 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 9.7 p30 -76.78 -10.09 59.13 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.24 -0.436 . . . . 34.21 110.833 179.915 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 52.15 46.49 56.47 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.701 -0.761 . . . . 53.54 112.501 -179.942 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 38.4 p-10 -89.08 -12.47 41.11 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.845 0.355 . . . . 75.22 110.853 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 105.44 -11.69 47.18 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.72 -0.752 . . . . 64.32 112.477 -179.965 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 56.0 p -133.59 130.69 38.71 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.788 0.328 . . . . 72.41 111.125 -179.827 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.529 HD12 ' HB ' ' A' ' 63' ' ' ILE . 47.3 mt -84.45 125.7 40.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.193 -0.458 . . . . 75.44 111.123 179.908 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.434 HG22 ' CG2' ' A' ' 62' ' ' THR . 28.3 p -107.81 171.09 7.59 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.158 -0.474 . . . . 62.53 111.109 179.989 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 16.3 p -54.21 -45.02 72.14 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.158 -0.474 . . . . 75.11 111.187 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 4.9 tmtm? -60.14 -37.3 79.67 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.177 -0.465 . . . . 74.04 110.911 179.91 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.474 ' O ' HG23 ' A' ' 35' ' ' VAL . 39.4 mt-10 -74.0 -32.86 63.59 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.265 -0.425 . . . . 73.22 110.89 179.939 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.586 HD13 ' O ' ' A' ' 32' ' ' LEU . 0.9 OUTLIER -74.28 -39.98 62.59 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.169 -0.469 . . . . 73.42 110.892 -179.967 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -71.58 -38.03 61.78 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.735 -0.745 . . . . 52.51 112.537 179.87 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.637 HG21 ' HE3' ' A' ' 21' ' ' LYS . 96.1 m -62.79 -55.96 21.75 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.817 0.341 . . . . 72.42 111.185 -179.899 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.474 HG23 ' O ' ' A' ' 31' ' ' GLU . 71.4 t -54.63 -51.79 47.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.208 -0.451 . . . . 62.31 111.13 179.875 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 26.4 mtp -52.08 -31.51 30.71 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.205 -0.452 . . . . 71.34 110.884 179.91 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 45.4 ttp180 -63.37 -43.92 96.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.245 -0.434 . . . . 74.53 110.865 -179.912 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' SER . . . . . 0.619 ' OG ' HD11 ' M' ' 41' ' ' LEU . 1.3 p -65.25 -34.22 77.85 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.163 -0.472 . . . . 51.55 110.85 -179.779 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.941 HD13 ' HB3' ' M' ' 37' ' ' ALA . 32.1 mt -72.11 -19.84 61.73 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.176 -0.465 . . . . 74.32 110.892 179.971 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 101.46 30.07 6.05 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.772 -0.728 . . . . 73.2 112.52 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 83.9 mm-40 -118.64 132.59 56.18 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.798 0.332 . . . . 55.3 110.928 -179.93 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 33.5 t-20 -109.88 76.63 0.98 Allowed Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.618 0.723 . . . . 64.43 110.864 -179.9 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' PRO . . . . . 0.422 ' CG ' HD21 ' A' ' 48' ' ' LEU . 53.6 Cg_endo -69.73 164.65 33.73 Favored 'Trans proline' 0 C--N 1.341 0.17 0 C-N-CA 122.69 2.26 . . . . 73.23 112.36 179.94 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 19.6 p -112.93 166.41 11.42 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.211 -0.45 . . . . 65.11 111.172 179.983 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -59.17 -42.26 90.4 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.229 -0.441 . . . . 75.15 110.891 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.23 -31.58 64.23 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.153 -0.476 . . . . 44.43 111.079 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -71.88 -52.1 19.01 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.212 -0.449 . . . . 61.35 110.893 -179.92 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.422 HD21 ' CG ' ' A' ' 43' ' ' PRO . 18.8 mt -56.09 -51.78 66.64 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.16 -0.473 . . . . 74.44 110.953 179.985 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 28.6 tp60 -52.85 -29.19 26.52 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.174 -0.466 . . . . 62.43 110.935 179.931 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -75.5 -43.4 49.32 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.213 -0.449 . . . . 72.24 110.892 179.915 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' MET . . . . . 0.437 ' HE1' HD13 ' M' ' 31' ' ' LEU . 68.2 mtp -58.31 -58.04 10.26 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.149 -0.478 . . . . 74.04 110.891 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 79.6 mt -55.89 -42.06 69.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.19 -0.459 . . . . 63.34 111.115 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 63.4 m-20 -60.51 -31.28 70.34 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.15 -0.477 . . . . 73.21 110.877 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -71.26 -23.29 61.95 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.196 -0.456 . . . . 75.01 110.912 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.488 HG11 HD23 ' M' ' 31' ' ' LEU . 2.9 m -114.0 10.87 8.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.15 -0.477 . . . . 34.51 111.135 179.973 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 23.2 t0 -90.16 97.67 11.32 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.156 -0.475 . . . . 72.34 110.868 179.943 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.29 -44.27 10.94 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.247 -0.433 . . . . 60.22 111.106 179.946 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 6.4 p-10 -83.09 -0.22 48.07 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.205 -0.452 . . . . 73.03 110.865 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 51.6 57.38 12.29 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.712 -0.756 . . . . 62.2 112.485 -179.952 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 53.1 p-10 -114.56 -15.72 11.97 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.853 0.359 . . . . 55.32 110.845 -179.848 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 89.28 17.81 54.62 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.771 -0.728 . . . . 72.23 112.459 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' THR . . . . . 0.434 ' CG2' HG22 ' A' ' 28' ' ' THR . 28.5 p -150.15 158.67 44.4 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.74 0.305 . . . . 75.53 111.145 -179.868 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.529 ' HB ' HD12 ' A' ' 27' ' ' ILE . 7.6 mm -94.6 110.12 23.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.267 -0.424 . . . . 71.55 111.14 179.924 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -77.47 -172.79 2.65 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.151 -0.477 . . . . 75.35 110.837 179.9 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.537 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 2.5 t80 -64.59 -58.31 13.92 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.621 0.724 . . . . 73.32 110.852 -179.942 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 66' ' ' PRO . . . . . 0.537 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 54.2 Cg_endo -69.76 -29.9 23.13 Favored 'Trans proline' 0 N--CA 1.465 -0.159 0 C-N-CA 122.698 2.265 . . . . 63.41 112.372 -179.981 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 11.5 mt-10 -57.17 -41.63 79.63 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.177 -0.465 . . . . 73.45 110.865 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 5.7 t80 -72.77 -36.12 67.58 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.166 -0.47 . . . . 72.1 110.845 -179.898 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 19.2 tp -65.42 -53.76 38.33 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.139 -0.482 . . . . 74.52 110.91 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 9.4 t -55.24 -28.38 52.83 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.212 -0.449 . . . . 53.2 111.157 179.944 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 6.2 tmm? -68.12 -40.07 82.58 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.181 -0.463 . . . . 52.22 110.897 179.911 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' MET . . . . . 0.471 ' HE2' HG11 ' M' ' 35' ' ' VAL . 0.0 OUTLIER -79.85 -33.57 40.06 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.194 -0.457 . . . . 65.22 110.861 179.967 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.296 0 CA-C-N 116.22 -0.446 . . . . 63.31 111.075 179.936 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.512 HD13 HG13 ' A' ' 142' ' ' VAL . 53.2 mt . . . . . 0 N--CA 1.457 -0.101 0 CA-C-O 120.83 0.347 . . . . 52.42 111.134 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 12.2 ttt180 -62.21 -28.33 69.61 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.146 -0.479 . . . . 63.4 110.858 179.977 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.731 ' O ' HG23 ' A' ' 91' ' ' VAL . 11.3 mm-40 -70.21 -58.38 3.84 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.221 -0.445 . . . . 75.41 110.91 -179.976 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 88' ' ' ALA . . . . . 0.621 ' HB1' ' CE2' ' A' ' 92' ' ' PHE . . . -54.29 -45.39 72.5 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.095 -0.502 . . . . 42.15 111.107 179.916 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 6.7 t80 -52.06 -51.33 58.24 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.211 -0.449 . . . . 74.23 110.909 -179.935 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 13.2 ttt85 -61.68 -40.52 95.26 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.121 -0.49 . . . . 70.1 110.869 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 91' ' ' VAL . . . . . 0.731 HG23 ' O ' ' A' ' 87' ' ' GLU . 39.0 t -59.45 -51.15 76.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.214 -0.448 . . . . 75.21 111.137 179.99 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.621 ' CE2' ' HB1' ' A' ' 88' ' ' ALA . 11.8 m-85 -68.56 -29.04 67.51 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.159 -0.473 . . . . 73.32 110.838 -179.972 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 33.1 t0 -70.45 94.09 0.94 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.158 -0.473 . . . . 62.01 110.881 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 2.6 mptm? -78.67 -52.09 8.92 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.215 -0.448 . . . . 75.42 110.869 -179.962 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 47.6 p30 -72.5 -9.17 58.23 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.219 -0.446 . . . . 64.21 110.895 179.86 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 59.95 28.71 66.54 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.7 -0.762 . . . . 64.11 112.521 -179.924 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 45.3 p-10 -82.39 -16.25 49.77 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.882 0.372 . . . . 73.35 110.896 -179.882 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 88.56 18.66 54.49 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.717 -0.754 . . . . 42.31 112.452 179.991 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 13.4 m-85 -136.03 159.41 41.78 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.841 0.353 . . . . 72.45 110.949 -179.827 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.419 HG21 HD13 ' A' ' 105' ' ' LEU . 71.4 mt -122.04 120.84 62.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.119 -0.491 . . . . 74.53 111.159 179.87 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 4.9 p -114.9 175.0 5.69 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.189 -0.46 . . . . 71.41 110.864 -179.905 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -66.15 -25.17 66.84 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.119 -0.491 . . . . 55.03 111.064 179.927 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -71.07 -49.94 39.22 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.228 -0.442 . . . . 75.2 111.125 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -76.97 -48.05 19.11 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.228 -0.442 . . . . 75.33 110.899 -179.965 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.525 HD21 ' CE ' ' A' ' 124' ' ' MET . 19.0 tp -53.14 -40.45 64.27 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.155 -0.475 . . . . 73.13 110.907 -179.957 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 41.6 ttp180 -56.49 -49.43 74.71 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.155 -0.475 . . . . 71.31 110.894 179.938 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 6.2 t60 -54.28 -36.46 63.68 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.171 -0.468 . . . . 73.23 110.818 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 85.7 t -63.53 -51.66 67.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.219 -0.446 . . . . 72.13 111.129 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 109' ' ' MET . . . . . 0.767 ' HE2' HD11 ' M' ' 19' ' ' ILE . 5.4 mmt -60.58 -26.02 66.64 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.239 -0.437 . . . . 75.44 110.866 179.931 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 1.6 m -66.77 -45.2 79.28 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.206 -0.452 . . . . 43.24 111.164 -179.956 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 5.6 t30 -55.29 -30.62 60.52 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.245 -0.434 . . . . 63.24 110.868 179.973 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.742 HD12 ' HA ' ' A' ' 109' ' ' MET . 7.8 mt -75.42 -25.41 57.5 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.227 -0.442 . . . . 71.12 110.945 179.949 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 101.02 32.98 5.12 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.706 -0.759 . . . . 71.34 112.487 179.866 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -124.25 109.96 14.04 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.873 0.368 . . . . 74.31 110.865 -179.8 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 19.2 mmtm -74.76 128.62 36.0 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.143 -0.48 . . . . 61.21 110.904 179.957 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.481 HD22 ' HG2' ' A' ' 120' ' ' GLU . 10.4 mt -133.17 126.69 32.2 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.235 -0.438 . . . . 75.21 110.904 179.954 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 117' ' ' THR . . . . . 0.624 ' O ' HG23 ' A' ' 121' ' ' VAL . 68.6 p -79.3 -175.06 4.48 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.212 -0.449 . . . . 55.01 111.109 179.952 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -59.84 -40.26 87.92 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.18 -0.464 . . . . 71.51 110.865 179.935 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -75.71 -33.39 60.32 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.253 -0.431 . . . . 73.42 110.86 -179.912 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 120' ' ' GLU . . . . . 0.481 ' HG2' HD22 ' A' ' 116' ' ' LEU . 46.8 tt0 -71.98 -38.17 69.74 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.163 -0.471 . . . . 63.22 110.894 -179.931 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.624 HG23 ' O ' ' A' ' 117' ' ' THR . 92.8 t -74.31 -30.55 26.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.181 -0.463 . . . . 75.24 111.109 179.973 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -78.54 -28.29 46.07 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.2 -0.455 . . . . 73.53 110.839 179.961 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 23.0 tp10 -55.52 -49.99 71.16 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.224 -0.444 . . . . 72.4 110.904 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 124' ' ' MET . . . . . 0.525 ' CE ' HD21 ' A' ' 105' ' ' LEU . 13.6 ptm -66.42 -44.12 83.83 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.156 -0.474 . . . . 50.42 110.922 179.953 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 29.3 mm -53.87 -35.38 27.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.175 -0.466 . . . . 75.34 111.138 179.945 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 14.1 ttt85 -67.18 -31.7 72.28 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.187 -0.46 . . . . 75.21 110.867 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 13.1 tp10 -69.14 -45.16 70.8 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.18 -0.464 . . . . 72.33 110.923 -179.975 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.602 ' HB3' HG22 ' A' ' 136' ' ' VAL . . . -77.12 -33.18 56.88 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.154 -0.476 . . . . 63.3 111.091 179.918 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 47.6 t0 -68.9 85.99 0.34 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.258 -0.428 . . . . 72.23 110.836 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 57.0 mt -79.69 -45.55 23.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.218 -0.446 . . . . 72.04 111.135 179.977 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 24.5 p30 -72.87 -8.63 56.46 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.175 -0.466 . . . . 61.34 110.854 179.849 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 62.72 41.91 99.77 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.793 -0.718 . . . . 52.51 112.463 -179.952 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 13.3 p-10 -87.6 -15.84 36.21 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.843 0.354 . . . . 75.23 110.851 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 102.41 4.23 49.99 Favored Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.687 -0.768 . . . . 62.32 112.482 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -149.19 172.18 15.26 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.861 0.362 . . . . 71.42 110.909 -179.873 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 136' ' ' VAL . . . . . 0.602 HG22 ' HB3' ' A' ' 128' ' ' ALA . 99.6 t -110.83 113.75 45.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.185 -0.461 . . . . 63.54 111.128 179.976 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 14.0 p30 -91.02 167.87 12.07 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.132 -0.486 . . . . 72.42 110.885 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 138' ' ' TYR . . . . . 0.594 ' O ' HG23 ' A' ' 142' ' ' VAL . 88.7 t80 -52.08 -47.17 65.32 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.171 -0.468 . . . . 64.55 110.92 -179.909 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 26.1 tp10 -52.53 -51.78 57.95 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.104 -0.498 . . . . 64.2 110.844 -179.983 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 51.7 mt-10 -66.16 -39.88 90.11 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.179 -0.464 . . . . 54.11 110.899 -179.919 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 75.7 t80 -59.45 -49.16 78.86 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.181 -0.463 . . . . 74.12 110.879 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 142' ' ' VAL . . . . . 0.594 HG23 ' O ' ' A' ' 138' ' ' TYR . 91.8 t -56.58 -40.08 66.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.164 -0.471 . . . . 75.43 111.162 179.94 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 6.9 tp-100 -70.01 -28.34 65.42 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.179 -0.464 . . . . 75.25 110.895 179.998 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 9.5 tpt -74.6 -54.03 8.24 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.229 -0.441 . . . . 61.5 110.89 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 145' ' ' MET . . . . . 0.484 ' HE2' ' HA ' ' M' ' 20' ' ' ARG . 7.7 ttm -66.88 -27.17 67.29 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.218 -0.446 . . . . 71.02 110.875 179.942 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 2.3 m . . . . . 0 C--N 1.329 -0.288 0 CA-C-N 116.233 -0.439 . . . . 54.23 111.139 -179.888 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' M' M ' 15' ' ' LYS . . . . . . . . . . . . . 24.1 mttp . . . . . 0 C--O 1.231 0.103 0 CA-C-O 120.736 0.303 . . . . 74.13 110.852 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' M' M ' 16' ' ' TRP . . . . . 0.707 ' CE3' HD12 ' M' ' 19' ' ' ILE . 46.2 m95 -52.77 -40.55 63.26 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.217 -0.447 . . . . 74.11 110.904 179.972 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' M' M ' 17' ' ' GLU . . . . . . . . . . . . . 28.5 tt0 -55.43 -26.28 41.0 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.234 -0.439 . . . . 55.51 110.87 -179.948 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' M' M ' 18' ' ' LYS . . . . . . . . . . . . . 16.2 ttpp -77.65 -28.02 51.16 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.145 -0.48 . . . . 73.32 110.841 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' M' M ' 19' ' ' ILE . . . . . 0.767 HD11 ' HE2' ' A' ' 109' ' ' MET . 60.2 mt -78.3 -29.38 15.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.22 -0.446 . . . . 63.32 111.164 179.894 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' M' M ' 20' ' ' ARG . . . . . 0.484 ' HA ' ' HE2' ' A' ' 145' ' ' MET . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.288 0 CA-C-N 116.157 -0.474 . . . . 63.13 110.906 179.906 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' M' M ' 30' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.232 0.143 0 CA-C-O 120.825 0.345 . . . . 74.22 110.905 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' M' M ' 31' ' ' LEU . . . . . 0.488 HD23 HG11 ' A' ' 55' ' ' VAL . 25.9 tp -141.72 -55.44 0.46 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.258 -0.428 . . . . 72.44 110.897 179.938 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' M' M ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.68 -45.38 48.71 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.183 -0.462 . . . . 55.12 110.909 179.851 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' M' M ' 33' ' ' HIS . . . . . . . . . . . . . 19.0 t-80 -50.36 -36.91 34.42 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.166 -0.47 . . . . 62.13 110.864 179.897 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' M' M ' 34' ' ' ILE . . . . . . . . . . . . . 49.7 mm -49.74 -40.83 16.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.191 -0.459 . . . . 51.14 111.171 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' M' M ' 35' ' ' VAL . . . . . 0.471 HG11 ' HE2' ' A' ' 72' ' ' MET . 65.9 t -49.26 -40.63 13.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.15 -0.477 . . . . 65.03 111.176 179.772 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' M' M ' 36' ' ' TRP . . . . . . . . . . . . . 28.8 m0 -59.31 -38.88 81.35 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.14 -0.482 . . . . 65.42 110.965 179.962 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' M' M ' 37' ' ' ALA . . . . . 0.941 ' HB3' HD13 ' A' ' 39' ' ' LEU . . . -63.9 -18.61 64.37 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.167 -0.47 . . . . 73.0 111.108 179.876 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' M' M ' 38' ' ' SER . . . . . . . . . . . . . 2.5 m -70.61 -17.97 62.89 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.234 -0.439 . . . . 53.42 110.86 -179.82 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' M' M ' 39' ' ' ARG . . . . . . . . . . . . . 16.2 mmm180 -60.13 -26.8 66.54 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.176 -0.466 . . . . 75.13 110.878 -179.932 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' M' M ' 40' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -74.63 -47.76 30.28 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.205 -0.452 . . . . 64.15 110.908 -179.946 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' M' M ' 41' ' ' LEU . . . . . 0.619 HD11 ' OG ' ' A' ' 38' ' ' SER . 15.3 mt . . . . . 0 C--N 1.328 -0.345 0 CA-C-N 116.17 -0.468 . . . . 62.43 110.92 -179.991 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 7.5 tp60 . . . . . 0 C--O 1.231 0.086 0 CA-C-O 120.732 0.301 . . . . 61.44 110.893 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 41.4 mt -68.58 -37.09 77.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.209 -0.451 . . . . 74.14 111.12 179.975 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -52.0 -33.16 37.03 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.15 -0.477 . . . . 75.32 111.139 179.815 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 16.2 mm-40 -74.9 -51.87 12.73 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.203 -0.453 . . . . 65.44 110.878 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.562 ' CB ' HD13 ' A' ' 69' ' ' LEU . 64.5 m-85 -58.18 -46.03 86.47 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.191 -0.459 . . . . 73.52 110.888 -179.925 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 19.5 ttmm -54.18 -30.45 49.58 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.159 -0.473 . . . . 75.13 110.886 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -70.84 -30.69 67.18 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.223 -0.444 . . . . 65.21 110.87 179.946 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -67.02 -48.16 69.22 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.16 -0.473 . . . . 65.2 111.083 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 79.2 t80 -56.09 -54.28 46.97 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.2 -0.454 . . . . 63.21 110.891 -179.932 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 20.6 t -58.99 -26.49 64.54 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.174 -0.466 . . . . 53.34 110.88 -179.8 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 1.2 tt -68.75 -37.33 79.31 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.117 -0.492 . . . . 73.14 110.909 -179.999 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.625 ' CD1' HG11 ' A' ' 35' ' ' VAL . 22.3 m-85 -81.33 -39.09 25.65 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.19 -0.459 . . . . 75.43 110.88 179.943 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 26.5 t0 -62.97 98.56 0.13 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.164 -0.471 . . . . 73.55 110.906 179.931 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.14 -56.05 6.24 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.223 -0.444 . . . . 75.13 110.919 179.978 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 2.3 p-10 -70.86 -10.45 59.62 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.212 -0.449 . . . . 70.23 110.859 179.901 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 50.86 66.43 2.47 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.708 -0.758 . . . . 74.02 112.496 -179.93 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 35.3 p-10 -114.47 -15.71 12.02 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.828 0.347 . . . . 51.42 110.848 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 100.53 10.28 44.62 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.755 -0.736 . . . . 75.23 112.457 -179.977 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 51.0 p -151.29 130.7 12.91 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.771 0.319 . . . . 61.4 111.135 -179.865 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.48 HD12 ' HB ' ' A' ' 63' ' ' ILE . 22.5 mt -91.08 121.78 41.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.218 -0.446 . . . . 74.01 111.071 179.952 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.411 ' HA ' HG22 ' A' ' 62' ' ' THR . 30.0 p -107.77 172.82 6.62 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.153 -0.476 . . . . 54.2 111.128 179.932 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.4 HG22 HD12 ' A' ' 52' ' ' ILE . 71.4 p -61.41 -27.55 68.61 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.201 -0.454 . . . . 71.3 111.164 -179.991 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 19.5 mmmt -75.7 -35.19 60.36 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.223 -0.444 . . . . 64.35 110.93 179.909 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 -76.06 -32.66 59.4 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.19 -0.459 . . . . 74.32 110.898 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.651 HD12 ' CD2' ' A' ' 48' ' ' LEU . 1.2 tm? -67.15 -39.79 86.6 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.123 -0.49 . . . . 65.2 110.93 -179.965 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -67.92 -35.51 84.68 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.71 -0.757 . . . . 72.45 112.528 179.849 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 74.6 m -62.81 -55.47 26.11 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.808 0.337 . . . . 54.41 111.158 -179.876 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.625 HG11 ' CD1' ' A' ' 19' ' ' PHE . 92.4 t -65.28 -53.32 41.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.248 -0.433 . . . . 75.35 111.109 179.901 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -51.9 -31.5 28.66 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.179 -0.464 . . . . 72.45 110.884 179.947 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 48.6 ttt180 -65.95 -47.09 75.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.221 -0.445 . . . . 71.2 110.897 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' SER . . . . . 0.629 ' OG ' HD11 ' M' ' 41' ' ' LEU . 1.3 p -63.66 -33.67 76.15 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.159 -0.473 . . . . 65.04 110.888 -179.81 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.948 HD13 ' HB3' ' M' ' 37' ' ' ALA . 57.7 mt -68.09 -22.11 64.93 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.1 -0.5 . . . . 73.02 110.91 -179.979 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 101.43 31.37 5.56 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.729 -0.748 . . . . 74.34 112.505 179.915 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 13.9 mt-30 -128.29 118.62 23.57 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.793 0.33 . . . . 64.01 110.911 -179.896 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 1.2 t30 -109.86 76.92 1.0 Allowed Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.65 0.738 . . . . 61.15 110.86 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' PRO . . . . . 0.521 ' HG2' HD21 ' A' ' 48' ' ' LEU . 53.3 Cg_endo -69.85 168.08 22.71 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.695 2.263 . . . . 65.44 112.297 179.982 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 30.9 p -90.78 161.69 15.18 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.234 -0.439 . . . . 71.32 111.081 -179.91 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 25.2 tt0 -51.95 -43.7 63.62 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.157 -0.474 . . . . 72.33 110.883 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.14 -31.49 64.3 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.142 -0.481 . . . . 61.25 111.063 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 53.7 tt0 -65.96 -48.25 71.93 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.238 -0.437 . . . . 60.04 110.917 -179.938 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.651 ' CD2' HD12 ' A' ' 32' ' ' LEU . 46.4 mt -55.34 -35.35 65.09 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.152 -0.476 . . . . 71.3 110.932 -179.984 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 43.8 tp60 -70.92 -28.96 64.9 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.184 -0.462 . . . . 72.13 110.873 179.945 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 29.3 t0 -68.73 -46.61 68.47 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.216 -0.447 . . . . 65.15 110.869 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' MET . . . . . 0.601 ' SD ' HD11 ' M' ' 34' ' ' ILE . 10.7 mtp -60.18 -53.0 62.9 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.184 -0.462 . . . . 72.31 110.877 179.992 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.667 HG23 HD11 ' A' ' 63' ' ' ILE . 73.3 mt -60.46 -41.25 86.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.226 -0.443 . . . . 51.22 111.159 179.962 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 70.7 m-20 -67.89 -32.73 73.42 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.155 -0.475 . . . . 74.33 110.894 179.934 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 18.4 mm-40 -61.01 -23.28 65.29 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.182 -0.463 . . . . 54.42 110.887 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.49 ' CG2' HD12 ' A' ' 63' ' ' ILE . 3.8 m -112.52 -14.89 10.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.162 -0.472 . . . . 40.01 111.109 179.96 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 33.0 t0 -66.79 97.07 0.44 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.172 -0.467 . . . . 71.51 110.85 179.936 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.46 -32.71 18.12 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.159 -0.473 . . . . 72.1 111.074 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -91.69 -0.43 57.56 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.234 -0.439 . . . . 72.25 110.851 179.983 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 51.46 62.21 5.68 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.699 -0.762 . . . . 41.15 112.509 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 50.7 p-10 -114.58 -15.75 11.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.864 0.364 . . . . 60.24 110.877 -179.873 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 89.11 15.83 58.54 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.751 -0.738 . . . . 63.1 112.49 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' THR . . . . . 0.411 HG22 ' HA ' ' A' ' 28' ' ' THR . 30.7 p -152.17 161.54 42.47 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.758 0.313 . . . . 74.54 111.143 -179.865 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.667 HD11 HG23 ' A' ' 52' ' ' ILE . 8.6 mm -99.26 114.8 38.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.194 -0.457 . . . . 72.52 111.133 179.921 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -81.79 -173.01 4.2 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.153 -0.476 . . . . 63.33 110.88 179.846 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.535 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 2.5 t80 -66.55 -58.3 10.38 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.669 0.747 . . . . 74.41 110.857 -179.911 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 66' ' ' PRO . . . . . 0.535 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 53.1 Cg_endo -69.78 -29.41 23.8 Favored 'Trans proline' 0 C--N 1.342 0.202 0 C-N-CA 122.677 2.251 . . . . 73.45 112.332 -179.947 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -61.48 -40.26 93.91 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.217 -0.447 . . . . 72.04 110.896 -179.976 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 14.7 t80 -74.52 -35.56 63.16 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.149 -0.478 . . . . 53.2 110.886 -179.955 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.562 HD13 ' CB ' ' A' ' 12' ' ' PHE . 19.0 tp -69.98 -54.16 14.49 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.121 -0.49 . . . . 72.21 110.921 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 14.8 t -51.93 -29.77 21.68 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.146 -0.479 . . . . 75.31 111.109 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 3.6 tmm? -61.86 -43.4 98.92 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.247 -0.433 . . . . 74.15 110.844 179.937 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' MET . . . . . 0.586 ' HE3' HG11 ' M' ' 35' ' ' VAL . 3.8 mmt -79.85 -29.4 40.06 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.249 -0.432 . . . . 71.31 110.846 179.999 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.273 0 CA-C-N 116.233 -0.44 . . . . 75.14 111.146 179.909 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.608 HD13 HG13 ' A' ' 142' ' ' VAL . 47.7 mt . . . . . 0 C--O 1.232 0.141 0 CA-C-O 120.804 0.335 . . . . 74.5 111.147 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 2.7 ttt180 -61.13 -32.42 72.12 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.167 -0.469 . . . . 71.14 110.865 179.942 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.715 ' O ' HG23 ' A' ' 91' ' ' VAL . 35.2 mt-10 -76.68 -57.18 4.0 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.224 -0.444 . . . . 62.41 110.9 -179.924 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 88' ' ' ALA . . . . . 0.437 ' HB1' ' CE2' ' A' ' 92' ' ' PHE . . . -53.49 -51.03 64.08 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.177 -0.465 . . . . 55.11 111.081 179.924 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -54.2 -41.79 69.0 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.191 -0.458 . . . . 54.11 110.878 -179.932 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 73.1 ttt180 -70.41 -27.32 64.19 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.161 -0.472 . . . . 62.5 110.9 -179.942 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 91' ' ' VAL . . . . . 0.715 HG23 ' O ' ' A' ' 87' ' ' GLU . 93.7 t -75.61 -28.26 19.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.178 -0.464 . . . . 62.3 111.141 -179.996 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.467 ' CE1' HG11 ' A' ' 108' ' ' VAL . 8.8 m-85 -93.08 -35.64 13.11 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.144 -0.48 . . . . 75.22 110.898 -179.974 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 35.1 t0 -64.67 94.16 0.12 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.125 -0.489 . . . . 61.52 110.857 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 10.1 tppt? -78.64 -51.52 9.76 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.193 -0.458 . . . . 74.35 110.915 179.961 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 17.8 p30 -72.7 -9.14 58.28 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.218 -0.446 . . . . 74.3 110.834 179.919 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 59.76 28.32 65.45 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.713 -0.756 . . . . 62.31 112.528 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 43.8 p-10 -81.85 -16.18 51.64 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.887 0.375 . . . . 70.11 110.893 -179.87 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 91.03 18.64 46.05 Favored Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.717 -0.754 . . . . 73.54 112.5 179.963 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 12.5 m-85 -136.6 148.18 47.36 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.907 0.384 . . . . 71.23 110.933 -179.812 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 78.8 mt -113.78 121.33 65.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.139 -0.482 . . . . 64.22 111.114 179.921 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 17.8 p -116.2 175.25 5.63 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.145 -0.479 . . . . 74.51 110.859 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 102' ' ' ALA . . . . . 0.405 ' HB1' HG12 ' A' ' 121' ' ' VAL . . . -66.33 -33.32 75.48 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.129 -0.487 . . . . 74.34 111.079 179.933 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -61.59 -49.93 74.64 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.251 -0.431 . . . . 73.42 111.076 179.987 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 23.7 mt-10 -76.91 -49.18 16.21 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.207 -0.452 . . . . 74.43 110.925 -179.962 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.535 HD21 ' CE ' ' A' ' 124' ' ' MET . 18.9 tp -53.3 -34.49 57.55 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.114 -0.494 . . . . 54.41 110.931 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 57.4 ttp180 -59.8 -48.05 83.23 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.2 -0.455 . . . . 75.25 110.843 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 70.9 t60 -54.38 -34.39 61.12 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.203 -0.453 . . . . 61.42 110.831 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.467 HG11 ' CE1' ' A' ' 92' ' ' PHE . 42.3 t -65.5 -48.9 81.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.243 -0.435 . . . . 72.43 111.139 -179.994 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 7.6 mmt -59.48 -45.06 92.75 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.163 -0.471 . . . . 54.14 110.866 179.922 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -57.56 -39.11 75.96 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.183 -0.462 . . . . 72.14 111.183 -179.942 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 10.6 t-20 -74.59 -26.55 59.99 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.168 -0.469 . . . . 72.22 110.9 179.966 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 12.3 mt -70.77 -25.97 63.14 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.238 -0.437 . . . . 63.42 110.903 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 101.01 33.02 5.11 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.724 -0.75 . . . . 74.14 112.452 179.862 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -124.05 113.43 18.38 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.948 0.404 . . . . 70.53 110.865 -179.863 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 115' ' ' LYS . . . . . 0.672 ' O ' HD23 ' A' ' 116' ' ' LEU . 9.1 pttm -70.32 118.68 13.44 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.131 -0.486 . . . . 74.42 110.913 179.967 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.672 HD23 ' O ' ' A' ' 115' ' ' LYS . 24.5 mt -137.41 163.3 31.39 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.2 -0.455 . . . . 71.23 110.89 179.97 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 117' ' ' THR . . . . . 0.453 ' O ' HG23 ' A' ' 121' ' ' VAL . 65.9 p -113.01 174.45 5.89 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.22 -0.445 . . . . 74.11 111.132 179.925 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -53.37 -48.11 68.88 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.223 -0.444 . . . . 64.11 110.875 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 49.9 tt0 -62.47 -38.57 90.35 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.23 -0.441 . . . . 72.12 110.886 -179.92 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 120' ' ' GLU . . . . . 0.655 ' HG2' HD22 ' A' ' 116' ' ' LEU . 7.4 tp10 -61.55 -46.77 88.52 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.143 -0.48 . . . . 72.52 110.897 -179.95 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.453 HG23 ' O ' ' A' ' 117' ' ' THR . 62.1 t -57.07 -32.22 39.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.18 -0.464 . . . . 71.32 111.127 179.974 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 3.1 t70 -78.51 -28.49 46.29 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.192 -0.458 . . . . 61.33 110.88 179.919 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 34.5 tp10 -55.6 -50.0 71.28 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.203 -0.453 . . . . 73.32 110.88 -179.928 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 124' ' ' MET . . . . . 0.535 ' CE ' HD21 ' A' ' 105' ' ' LEU . 13.4 ptm -66.61 -44.36 82.29 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.16 -0.473 . . . . 53.35 110.878 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 28.9 mm -53.88 -35.47 27.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.189 -0.46 . . . . 65.12 111.099 179.959 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 18.3 ttt-85 -66.88 -31.58 72.28 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.197 -0.456 . . . . 73.44 110.868 179.983 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 6.9 tm-20 -70.36 -47.26 61.79 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.164 -0.471 . . . . 75.15 110.83 -179.896 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.47 ' HB3' HG22 ' A' ' 136' ' ' VAL . . . -74.23 -33.8 63.47 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.184 -0.462 . . . . 65.32 111.068 179.957 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 50.1 t0 -68.54 86.74 0.31 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.257 -0.429 . . . . 62.33 110.867 -179.999 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 57.7 mt -79.75 -45.61 23.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.182 -0.463 . . . . 73.14 111.116 -179.992 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 22.9 p30 -72.73 -8.69 56.62 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.201 -0.454 . . . . 73.33 110.851 179.864 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 62.31 41.57 99.74 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.769 -0.729 . . . . 62.04 112.517 -179.925 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 34.6 p-10 -86.85 -15.91 37.71 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.851 0.358 . . . . 73.24 110.848 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 101.93 3.72 51.78 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.76 -0.733 . . . . 62.43 112.47 -179.94 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 3.5 tt0 -149.23 172.22 15.21 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.83 0.348 . . . . 53.33 110.895 -179.892 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 136' ' ' VAL . . . . . 0.47 HG22 ' HB3' ' A' ' 128' ' ' ALA . 95.0 t -111.66 108.56 25.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.214 -0.448 . . . . 73.34 111.134 180.0 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 17.5 p30 -86.24 175.62 8.38 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.163 -0.471 . . . . 62.53 110.877 -179.977 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 138' ' ' TYR . . . . . 0.604 ' O ' HG23 ' A' ' 142' ' ' VAL . 39.6 t80 -60.94 -46.52 90.38 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.193 -0.458 . . . . 54.32 110.968 -179.963 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 79.4 tt0 -52.62 -36.45 56.48 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.054 -0.521 . . . . 74.25 110.878 -179.977 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -78.41 -40.62 35.39 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.145 -0.479 . . . . 75.33 110.872 -179.911 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 141' ' ' PHE . . . . . 0.577 ' HD1' HG23 ' A' ' 85' ' ' ILE . 26.7 t80 -62.31 -46.92 86.56 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.177 -0.465 . . . . 74.22 110.88 -179.891 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 142' ' ' VAL . . . . . 0.608 HG13 HD13 ' A' ' 85' ' ' ILE . 83.1 t -51.61 -46.93 38.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.186 -0.461 . . . . 73.32 111.164 179.917 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 3.8 tt0 -71.9 -24.96 61.74 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.175 -0.466 . . . . 70.32 110.939 179.998 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 7.0 tpt -74.04 -42.36 60.38 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.192 -0.458 . . . . 71.13 110.883 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -71.77 -27.7 63.14 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.238 -0.437 . . . . 72.23 110.901 179.926 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 1.8 m . . . . . 0 C--N 1.33 -0.272 0 CA-C-N 116.239 -0.437 . . . . 72.22 111.098 -179.885 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' M' M ' 15' ' ' LYS . . . . . . . . . . . . . 7.3 mtmp? . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.753 0.311 . . . . 70.14 110.917 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' M' M ' 16' ' ' TRP . . . . . 0.721 ' CE3' HD12 ' M' ' 19' ' ' ILE . 18.0 m95 -54.6 -41.14 69.57 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.149 -0.478 . . . . 73.3 110.953 179.917 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' M' M ' 17' ' ' GLU . . . . . . . . . . . . . 15.8 tt0 -57.87 -26.57 62.28 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.215 -0.448 . . . . 71.42 110.862 -179.974 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' M' M ' 18' ' ' LYS . . . . . . . . . . . . . 19.8 tttp -73.5 -25.75 60.58 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.165 -0.471 . . . . 54.01 110.916 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' M' M ' 19' ' ' ILE . . . . . 0.721 HD12 ' CE3' ' M' ' 16' ' ' TRP . 31.5 mt -82.63 -20.96 9.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.194 -0.457 . . . . 73.22 111.103 179.882 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' M' M ' 20' ' ' ARG . . . . . . . . . . . . . 36.6 ttm180 . . . . . 0 C--N 1.329 -0.324 0 CA-C-N 116.199 -0.455 . . . . 71.44 110.921 179.918 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' M' M ' 30' ' ' LYS . . . . . . . . . . . . . 11.4 tttm . . . . . 0 C--O 1.233 0.186 0 CA-C-O 120.791 0.329 . . . . 62.43 110.896 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' M' M ' 31' ' ' LEU . . . . . 0.569 HD12 HD12 ' M' ' 34' ' ' ILE . 10.0 tp 179.72 -47.87 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.265 -0.425 . . . . 60.12 110.925 179.917 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' M' M ' 32' ' ' LYS . . . . . . . . . . . . . 1.3 ttmm -48.26 -45.8 34.9 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.179 -0.464 . . . . 74.34 110.879 179.816 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' M' M ' 33' ' ' HIS . . . . . . . . . . . . . 35.1 t60 -49.99 -39.82 42.31 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.211 -0.449 . . . . 73.43 110.877 179.928 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' M' M ' 34' ' ' ILE . . . . . 0.601 HD11 ' SD ' ' A' ' 51' ' ' MET . 58.9 mt -50.08 -40.21 16.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.197 -0.456 . . . . 71.11 111.091 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' M' M ' 35' ' ' VAL . . . . . 0.586 HG11 ' HE3' ' A' ' 72' ' ' MET . 62.5 t -48.36 -41.29 10.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.227 -0.442 . . . . 74.42 111.101 179.864 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' M' M ' 36' ' ' TRP . . . . . . . . . . . . . 22.0 m0 -58.43 -40.47 82.6 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.217 -0.447 . . . . 73.12 110.914 179.988 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' M' M ' 37' ' ' ALA . . . . . 0.948 ' HB3' HD13 ' A' ' 39' ' ' LEU . . . -64.09 -18.85 64.79 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.201 -0.454 . . . . 45.55 111.106 179.888 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' M' M ' 38' ' ' SER . . . . . . . . . . . . . 1.1 m -69.31 -17.94 63.77 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.223 -0.444 . . . . 72.2 110.84 -179.764 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' M' M ' 39' ' ' ARG . . . . . . . . . . . . . 45.0 mtp180 -71.51 -21.76 61.88 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.163 -0.471 . . . . 41.42 110.869 -179.93 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' M' M ' 40' ' ' GLU . . . . . . . . . . . . . 22.2 mm-40 -73.94 -48.0 33.71 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.206 -0.452 . . . . 54.42 110.924 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' M' M ' 41' ' ' LEU . . . . . 0.629 HD11 ' OG ' ' A' ' 38' ' ' SER . 13.6 mt . . . . . 0 C--N 1.328 -0.341 0 CA-C-N 116.174 -0.466 . . . . 73.04 110.939 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 1.2 tp-100 . . . . . 0 C--O 1.232 0.147 0 CA-C-O 120.777 0.322 . . . . 72.23 110.899 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 9' ' ' ILE . . . . . 0.668 HG23 HD22 ' A' ' 69' ' ' LEU . 54.6 mt -69.68 -40.12 78.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.252 -0.431 . . . . 42.31 111.156 179.931 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.63 -26.05 66.74 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.135 -0.484 . . . . 71.31 111.085 179.847 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 15.4 mm-40 -74.15 -51.93 14.07 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.261 -0.427 . . . . 73.23 110.867 -179.92 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 16.6 m-85 -69.03 -38.06 78.97 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.213 -0.449 . . . . 65.13 110.902 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 19.7 ttmt -52.09 -50.38 61.73 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.141 -0.481 . . . . 71.02 110.928 179.932 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -56.54 -37.25 70.24 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.171 -0.468 . . . . 63.33 110.885 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -59.6 -25.56 64.72 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.169 -0.469 . . . . 54.42 111.071 179.952 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 73.8 t80 -70.94 -54.03 12.84 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.215 -0.448 . . . . 64.34 110.842 -179.895 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 74.9 m -52.79 -31.37 38.23 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.131 -0.486 . . . . 73.33 110.892 -179.768 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.427 HD23 ' HB3' ' M' ' 38' ' ' SER . 16.3 tp -63.07 -39.93 96.18 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.101 -0.499 . . . . 74.42 110.902 -179.996 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.645 ' CD1' HG11 ' A' ' 35' ' ' VAL . 33.7 m-85 -79.61 -35.88 38.86 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.213 -0.449 . . . . 71.44 110.899 179.916 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 16.1 t0 -67.56 98.51 0.68 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.165 -0.47 . . . . 64.04 110.919 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 3.2 tppt? -70.28 -54.31 13.22 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.209 -0.45 . . . . 72.43 110.911 -179.96 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 19.3 p-10 -75.73 -10.04 59.1 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.221 -0.445 . . . . 52.41 110.88 179.848 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 52.18 46.09 56.95 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.732 -0.747 . . . . 60.55 112.482 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 25.0 p-10 -93.59 -15.75 25.08 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.854 0.359 . . . . 64.51 110.891 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 100.32 18.04 22.75 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.789 -0.719 . . . . 42.2 112.479 -179.942 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -154.62 130.82 10.35 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.776 0.322 . . . . 73.51 111.142 -179.858 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.488 HG22 ' HB2' ' A' ' 32' ' ' LEU . 25.6 mt -94.25 119.84 42.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.205 -0.452 . . . . 74.4 111.182 179.896 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.661 HG22 ' CG2' ' A' ' 62' ' ' THR . 20.2 p -107.61 176.24 5.22 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.182 -0.463 . . . . 74.24 111.166 -179.986 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.424 HG23 ' CD1' ' A' ' 52' ' ' ILE . 1.5 p -66.8 -33.95 76.74 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.26 -0.427 . . . . 72.42 111.14 -179.962 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 45.3 mtmt -61.44 -50.13 74.02 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.237 -0.438 . . . . 74.35 110.879 179.923 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.553 ' O ' HG23 ' A' ' 35' ' ' VAL . 8.2 mt-10 -76.06 -52.88 9.24 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.244 -0.435 . . . . 72.44 110.893 179.955 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.488 ' HB2' HG22 ' A' ' 27' ' ' ILE . 3.0 tm? -53.34 -40.67 65.07 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.169 -0.468 . . . . 73.42 110.922 -179.979 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -70.15 -30.66 69.5 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.785 -0.721 . . . . 45.01 112.491 179.893 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 96.6 m -74.48 -46.13 41.58 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.771 0.32 . . . . 74.31 111.12 -179.862 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.645 HG11 ' CD1' ' A' ' 19' ' ' PHE . 47.4 t -51.54 -47.37 36.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.233 -0.44 . . . . 51.42 111.144 179.892 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' MET . . . . . 0.602 ' SD ' HD13 ' M' ' 34' ' ' ILE . 0.0 OUTLIER -56.22 -34.8 66.64 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.2 -0.454 . . . . 73.22 110.869 179.89 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 42.1 ttt-85 -56.41 -40.36 74.56 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.229 -0.442 . . . . 62.45 110.911 -179.912 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' SER . . . . . 0.681 ' OG ' HD21 ' M' ' 41' ' ' LEU . 5.2 t -76.54 -26.26 54.97 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.181 -0.463 . . . . 72.43 110.839 -179.807 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 1.011 HD13 ' HB3' ' M' ' 37' ' ' ALA . 60.9 mt -81.48 -21.92 38.4 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.116 -0.493 . . . . 71.1 110.933 -179.99 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 101.45 31.32 5.57 Favored Glycine 0 N--CA 1.452 -0.251 0 C-N-CA 120.722 -0.751 . . . . 45.14 112.477 179.856 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 5.7 mm100 -122.62 124.82 44.35 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.796 0.331 . . . . 75.01 110.923 -179.895 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 1.1 t30 -109.87 76.58 0.97 Allowed Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.603 0.716 . . . . 74.43 110.911 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' PRO . . . . . 0.442 ' CG ' HD21 ' A' ' 48' ' ' LEU . 54.2 Cg_endo -69.71 167.97 22.82 Favored 'Trans proline' 0 C--O 1.232 0.177 0 C-N-CA 122.675 2.25 . . . . 72.02 112.397 179.908 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 20.0 p -110.07 154.14 23.66 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.228 -0.442 . . . . 63.24 111.138 -179.963 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 20.5 tt0 -51.91 -38.84 57.78 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.222 -0.445 . . . . 64.43 110.895 -179.994 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.33 -31.61 64.08 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.127 -0.488 . . . . 73.04 111.075 179.9 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -72.77 -52.6 14.39 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.209 -0.45 . . . . 65.41 110.895 -179.9 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.456 HD22 HD12 ' A' ' 32' ' ' LEU . 9.3 mt -55.15 -38.39 68.2 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.128 -0.487 . . . . 74.44 110.928 -179.952 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -64.48 -31.72 73.05 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.145 -0.48 . . . . 71.15 110.935 179.916 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 26.4 t0 -72.65 -42.11 64.71 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.204 -0.453 . . . . 73.42 110.864 179.969 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 41.6 mtp -65.71 -57.4 8.12 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.179 -0.464 . . . . 71.24 110.907 179.963 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.424 ' CD1' HG23 ' A' ' 29' ' ' THR . 62.0 mt -53.27 -45.64 55.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.216 -0.447 . . . . 64.32 111.155 179.941 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 83.0 m-20 -62.71 -29.76 70.9 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.204 -0.453 . . . . 73.42 110.891 179.915 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.36 -22.68 61.11 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.221 -0.445 . . . . 72.14 110.885 -179.983 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 35.7 m -112.96 6.28 8.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.128 -0.487 . . . . 60.25 111.176 179.963 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 30.2 t0 -86.15 97.75 10.51 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.137 -0.483 . . . . 73.42 110.891 179.923 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.28 -41.35 12.96 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.225 -0.443 . . . . 62.52 111.064 -179.993 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 57.7 p-10 -85.71 -0.13 54.32 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.197 -0.456 . . . . 74.12 110.872 -179.993 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 54.27 56.62 20.62 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.731 -0.747 . . . . 73.23 112.534 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 51.6 p-10 -114.4 -15.74 12.05 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.929 0.395 . . . . 75.12 110.914 -179.872 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 90.21 18.99 47.92 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.77 -0.729 . . . . 72.11 112.465 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' THR . . . . . 0.661 ' CG2' HG22 ' A' ' 28' ' ' THR . 73.7 p -150.67 163.81 37.63 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.753 0.311 . . . . 74.05 111.131 -179.881 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 21.7 mt -97.96 111.05 26.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.207 -0.452 . . . . 45.43 111.122 179.909 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -78.43 -172.57 2.93 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.137 -0.483 . . . . 75.12 110.865 179.875 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.541 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 2.4 t80 -65.41 -57.67 14.17 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.623 0.725 . . . . 63.5 110.891 -179.926 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 66' ' ' PRO . . . . . 0.541 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 53.6 Cg_endo -69.78 -23.52 30.61 Favored 'Trans proline' 0 N--CA 1.465 -0.148 0 C-N-CA 122.717 2.278 . . . . 54.31 112.337 -180.0 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 15.2 mt-10 -64.45 -43.09 95.36 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.227 -0.442 . . . . 73.21 110.856 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 41.0 t80 -71.32 -36.76 71.71 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.148 -0.478 . . . . 72.22 110.866 -179.897 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.668 HD22 HG23 ' A' ' 9' ' ' ILE . 57.0 tp -70.87 -53.88 13.54 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.123 -0.49 . . . . 63.51 110.929 -179.98 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 70' ' ' THR . . . . . 0.511 HG22 ' O ' ' A' ' 66' ' ' PRO . 12.8 t -59.92 -26.83 66.25 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.148 -0.478 . . . . 54.51 111.159 179.935 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 10.1 tmm? -63.33 -51.15 67.19 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.201 -0.454 . . . . 70.15 110.86 179.923 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -50.89 -45.68 60.2 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.252 -0.431 . . . . 74.51 110.883 179.936 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.194 -0.457 . . . . 63.31 111.113 179.929 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.762 HG21 HG22 ' A' ' 142' ' ' VAL . 39.1 mt . . . . . 0 N--CA 1.457 -0.099 0 CA-C-O 120.823 0.344 . . . . 74.22 111.13 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 13.9 ttt180 -59.95 -41.72 92.47 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.17 -0.468 . . . . 71.21 110.867 179.962 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.693 ' O ' HG23 ' A' ' 91' ' ' VAL . 28.3 tt0 -52.11 -47.86 65.06 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.213 -0.449 . . . . 74.54 110.872 -179.946 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 88' ' ' ALA . . . . . 0.505 ' HB1' ' CE2' ' A' ' 92' ' ' PHE . . . -74.55 -50.04 19.57 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.134 -0.485 . . . . 75.44 111.087 179.936 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 4.3 t80 -51.92 -34.53 42.01 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.231 -0.441 . . . . 63.04 110.838 -179.902 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -72.93 -46.01 54.89 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.156 -0.475 . . . . 73.35 110.903 -179.884 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 91' ' ' VAL . . . . . 0.693 HG23 ' O ' ' A' ' 87' ' ' GLU . 65.1 t -61.16 -31.01 48.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.181 -0.463 . . . . 74.5 111.156 179.922 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.697 ' CE1' HG11 ' A' ' 108' ' ' VAL . 21.0 m-85 -86.42 -44.07 12.32 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.156 -0.475 . . . . 74.15 110.93 179.972 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 44.2 t0 -67.78 87.95 0.24 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.123 -0.489 . . . . 64.31 110.866 179.979 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 2.3 tppt? -78.56 -47.16 17.79 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.212 -0.449 . . . . 63.43 110.863 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 9.5 p30 -72.65 -9.06 58.16 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.236 -0.438 . . . . 75.42 110.858 179.901 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 60.35 31.16 73.02 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.729 -0.748 . . . . 62.31 112.487 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 34.0 p-10 -81.89 -16.15 51.59 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.863 0.363 . . . . 75.23 110.879 -179.87 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 81.88 18.65 67.22 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.681 -0.771 . . . . 64.33 112.479 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 14.1 m-85 -142.49 142.93 32.36 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.852 0.358 . . . . 72.25 110.887 -179.808 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 62.3 mt -108.0 130.49 60.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.072 -0.513 . . . . 72.14 111.13 179.945 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 96.6 p -115.24 -171.76 2.01 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.201 -0.454 . . . . 62.33 110.86 -179.908 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 102' ' ' ALA . . . . . 0.607 ' HB2' HG13 ' A' ' 125' ' ' ILE . . . -76.15 -40.12 53.38 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.136 -0.484 . . . . 73.33 111.079 179.95 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -64.16 -37.95 89.31 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.168 -0.469 . . . . 64.41 111.106 179.962 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 104' ' ' GLU . . . . . 0.737 ' O ' HG23 ' A' ' 108' ' ' VAL . 56.6 mt-10 -67.83 -50.27 57.64 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.221 -0.445 . . . . 64.52 110.885 -179.948 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.554 HD11 HD13 ' M' ' 19' ' ' ILE . 22.1 tp -55.25 -54.86 38.08 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.12 -0.491 . . . . 74.5 110.877 -179.938 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 106' ' ' ARG . . . . . 0.444 ' O ' HG23 ' A' ' 110' ' ' THR . 37.0 ttp180 -52.24 -44.81 65.04 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.224 -0.443 . . . . 75.32 110.884 179.971 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 67.3 t60 -59.48 -34.38 72.5 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.149 -0.478 . . . . 70.51 110.892 179.969 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.737 HG23 ' O ' ' A' ' 104' ' ' GLU . 21.7 t -74.49 -52.37 19.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.196 -0.456 . . . . 64.31 111.142 179.977 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 109' ' ' MET . . . . . 0.747 ' HG2' HD11 ' A' ' 116' ' ' LEU . 0.3 OUTLIER -60.41 -41.94 94.97 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.148 -0.478 . . . . 73.14 110.901 179.896 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 110' ' ' THR . . . . . 0.444 HG23 ' O ' ' A' ' 106' ' ' ARG . 11.3 p -53.51 -32.35 50.0 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.192 -0.458 . . . . 74.43 111.088 -179.936 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 22.6 t-20 -74.6 -29.41 61.3 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.243 -0.435 . . . . 74.42 110.876 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 2.1 mt -70.68 -24.36 62.66 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.219 -0.446 . . . . 64.14 110.905 179.944 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 101.02 32.93 5.14 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.765 -0.731 . . . . 64.03 112.531 179.924 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -112.4 114.54 27.31 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.917 0.389 . . . . 71.51 110.874 -179.832 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 3.2 ttpm? -64.61 123.35 19.07 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.158 -0.474 . . . . 64.22 110.881 179.947 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.747 HD11 ' HG2' ' A' ' 109' ' ' MET . 8.5 mt -141.34 155.79 45.91 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.181 -0.463 . . . . 70.34 110.926 179.901 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 30.3 p -118.87 167.47 11.68 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.227 -0.442 . . . . 54.4 111.177 179.911 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 69.8 m-20 -51.98 -37.53 53.43 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.218 -0.447 . . . . 73.33 110.852 179.927 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -72.67 -34.85 67.5 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.2 -0.454 . . . . 74.44 110.881 -179.891 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -64.91 -45.87 84.1 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.178 -0.465 . . . . 61.43 110.842 -179.917 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.487 ' CG1' ' HB1' ' A' ' 102' ' ' ALA . 88.9 t -56.21 -30.65 30.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.179 -0.464 . . . . 63.33 111.153 179.98 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 54.8 t0 -66.52 -45.67 78.73 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.173 -0.467 . . . . 73.14 110.864 179.921 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -55.82 -29.48 59.86 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.213 -0.449 . . . . 72.11 110.906 -179.914 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 25.1 mtp -75.76 -59.51 2.72 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.171 -0.468 . . . . 74.53 110.896 179.935 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.607 HG13 ' HB2' ' A' ' 102' ' ' ALA . 34.2 mm -54.08 -35.61 29.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.243 -0.435 . . . . 64.42 111.156 179.981 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 4.9 tmm_? -66.3 -31.72 72.69 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.135 -0.484 . . . . 75.3 110.873 179.953 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -70.67 -48.22 55.93 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.231 -0.44 . . . . 74.24 110.897 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.543 ' HB3' ' CG2' ' A' ' 136' ' ' VAL . . . -73.12 -33.05 65.32 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.175 -0.466 . . . . 43.44 111.1 179.931 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 50.6 t0 -69.18 86.31 0.39 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.196 -0.456 . . . . 71.4 110.898 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 130' ' ' ILE . . . . . 0.669 HD12 ' HG2' ' A' ' 140' ' ' GLU . 3.5 mt -79.95 -45.24 22.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.219 -0.446 . . . . 62.25 111.131 179.998 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 23.3 p30 -72.65 -8.9 57.6 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.188 -0.46 . . . . 74.03 110.881 179.855 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 62.94 45.36 95.82 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.747 -0.74 . . . . 52.42 112.506 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 31.6 p-10 -91.65 -16.15 27.46 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.894 0.378 . . . . 73.13 110.885 -179.957 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 101.94 3.8 51.7 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.73 -0.747 . . . . 64.41 112.489 -179.937 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 5.8 tt0 -149.34 172.31 15.11 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.832 0.349 . . . . 71.12 110.917 -179.882 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 136' ' ' VAL . . . . . 0.543 ' CG2' ' HB3' ' A' ' 128' ' ' ALA . 67.8 t -115.55 114.29 45.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.185 -0.461 . . . . 65.34 111.099 179.967 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 48.4 p-10 -94.01 -172.41 2.83 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.123 -0.489 . . . . 70.13 110.899 179.979 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 138' ' ' TYR . . . . . 0.732 ' O ' HG23 ' A' ' 142' ' ' VAL . 47.5 t80 -68.46 -49.26 61.15 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.185 -0.461 . . . . 74.14 110.918 -179.927 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -51.63 -46.68 63.73 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.172 -0.467 . . . . 64.51 110.884 179.982 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 140' ' ' GLU . . . . . 0.669 ' HG2' HD12 ' A' ' 130' ' ' ILE . 97.5 mt-10 -70.87 -40.86 72.03 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.162 -0.472 . . . . 72.11 110.929 -179.949 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 88.0 t80 -59.68 -35.5 74.58 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.12 -0.491 . . . . 70.32 110.917 -179.969 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 142' ' ' VAL . . . . . 0.762 HG22 HG21 ' A' ' 85' ' ' ILE . 94.2 t -64.1 -37.52 80.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.104 -0.498 . . . . 33.33 111.112 -179.99 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 16.4 tm0? -70.34 -33.13 71.11 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.152 -0.477 . . . . 64.41 110.951 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 8.8 tpt -74.71 -56.31 4.93 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.225 -0.443 . . . . 71.14 110.885 179.919 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 5.0 ttm -60.54 -27.91 68.02 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.216 -0.447 . . . . 73.43 110.906 179.952 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 2.5 m . . . . . 0 C--N 1.329 -0.286 0 CA-C-N 116.209 -0.45 . . . . 63.41 111.116 -179.924 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' M' M ' 15' ' ' LYS . . . . . . . . . . . . . 19.2 mtmm . . . . . 0 C--O 1.231 0.099 0 CA-C-O 120.774 0.321 . . . . 70.15 110.894 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' M' M ' 16' ' ' TRP . . . . . 0.783 ' CE3' HD12 ' M' ' 19' ' ' ILE . 17.9 m95 -52.06 -47.21 65.23 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.251 -0.432 . . . . 71.31 110.943 179.934 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' M' M ' 17' ' ' GLU . . . . . . . . . . . . . 18.1 tt0 -57.47 -26.22 60.92 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.282 -0.417 . . . . 74.51 110.892 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' M' M ' 18' ' ' LYS . . . . . . . . . . . . . 6.0 ttpm? -73.06 -25.8 61.05 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.11 -0.496 . . . . 73.32 110.885 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' M' M ' 19' ' ' ILE . . . . . 0.783 HD12 ' CE3' ' M' ' 16' ' ' TRP . 28.7 mt -76.64 -21.79 14.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.253 -0.431 . . . . 45.45 111.116 179.896 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' M' M ' 20' ' ' ARG . . . . . . . . . . . . . 43.1 ttt180 . . . . . 0 C--N 1.329 -0.285 0 CA-C-N 116.187 -0.46 . . . . 74.31 110.859 179.931 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' M' M ' 30' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.232 0.154 0 CA-C-O 120.789 0.328 . . . . 74.33 110.878 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' M' M ' 31' ' ' LEU . . . . . 0.665 HD12 HD12 ' M' ' 34' ' ' ILE . 12.3 tp -136.73 -41.25 0.61 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.226 -0.443 . . . . 51.12 110.924 179.886 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' M' M ' 32' ' ' LYS . . . . . . . . . . . . . 12.2 ptmm? -47.13 -42.15 18.79 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.247 -0.433 . . . . 64.24 110.911 179.791 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' M' M ' 33' ' ' HIS . . . . . . . . . . . . . 19.4 t60 -49.12 -44.4 42.33 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.218 -0.446 . . . . 73.43 110.843 179.871 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' M' M ' 34' ' ' ILE . . . . . 0.665 HD12 HD12 ' M' ' 31' ' ' LEU . 77.7 mt -51.54 -38.34 20.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.199 -0.455 . . . . 52.24 111.168 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' M' M ' 35' ' ' VAL . . . . . . . . . . . . . 38.1 t -50.14 -39.17 15.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.195 -0.457 . . . . 73.52 111.08 179.872 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' M' M ' 36' ' ' TRP . . . . . . . . . . . . . 22.5 m0 -59.06 -39.13 81.11 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.182 -0.463 . . . . 75.22 110.907 179.966 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' M' M ' 37' ' ' ALA . . . . . 1.011 ' HB3' HD13 ' A' ' 39' ' ' LEU . . . -64.22 -18.52 64.59 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.222 -0.445 . . . . 72.04 111.099 179.939 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' M' M ' 38' ' ' SER . . . . . 0.427 ' HB3' HD23 ' A' ' 18' ' ' LEU . 0.7 OUTLIER -73.13 -17.87 61.35 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.215 -0.448 . . . . 61.24 110.817 -179.744 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' M' M ' 39' ' ' ARG . . . . . . . . . . . . . 1.4 tpt180 -58.68 -25.6 63.0 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.165 -0.47 . . . . 74.51 110.897 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' M' M ' 40' ' ' GLU . . . . . . . . . . . . . 2.4 pt-20 -87.07 -27.89 22.88 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.142 -0.481 . . . . 72.22 110.894 -179.939 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' M' M ' 41' ' ' LEU . . . . . 0.681 HD21 ' OG ' ' A' ' 38' ' ' SER . 11.3 mt . . . . . 0 C--N 1.329 -0.32 0 CA-C-N 116.147 -0.478 . . . . 72.24 110.923 179.993 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 24.6 tt0 . . . . . 0 C--O 1.232 0.15 0 CA-C-O 120.764 0.316 . . . . 74.42 110.904 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 3.2 mp -62.66 -52.33 61.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.235 -0.439 . . . . 75.22 111.077 -179.976 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -52.0 -33.76 39.74 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.187 -0.461 . . . . 74.45 111.114 179.8 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -74.9 -51.66 13.28 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.192 -0.458 . . . . 72.21 110.864 -179.897 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 16.5 m-85 -58.2 -42.22 85.69 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.17 -0.468 . . . . 53.31 110.891 -179.899 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -51.91 -37.85 54.04 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.131 -0.486 . . . . 72.41 110.892 179.986 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 -66.13 -35.83 81.52 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.252 -0.431 . . . . 50.13 110.831 179.978 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -65.63 -41.06 93.08 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.164 -0.471 . . . . 73.14 111.078 179.943 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.406 ' CE1' HD11 ' A' ' 27' ' ' ILE . 85.3 t80 -53.4 -51.58 62.1 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.253 -0.43 . . . . 72.44 110.881 -179.927 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 14.7 p -53.23 -32.71 49.63 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.176 -0.465 . . . . 64.44 110.857 -179.824 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 17.5 tp -64.58 -38.92 92.68 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.141 -0.481 . . . . 74.25 110.879 -179.991 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.642 ' CE1' HG11 ' A' ' 35' ' ' VAL . 48.1 m-85 -82.04 -27.65 32.92 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.233 -0.44 . . . . 75.12 110.888 179.966 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -82.83 98.56 9.21 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.164 -0.471 . . . . 54.25 110.835 179.962 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 40.4 mmtt -69.91 -54.14 14.73 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.197 -0.456 . . . . 73.35 110.878 179.969 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 22.3 p-10 -77.2 -10.12 59.21 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.215 -0.448 . . . . 72.31 110.879 179.879 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 52.02 42.26 54.07 Favored Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.726 -0.75 . . . . 73.41 112.453 -179.959 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 29.9 p-10 -88.57 -15.66 34.53 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.872 0.367 . . . . 71.11 110.882 -179.998 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 105.4 -11.74 47.36 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.723 -0.751 . . . . 74.12 112.463 -179.965 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 34.0 p -125.8 130.78 52.1 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.723 0.297 . . . . 54.43 111.168 -179.818 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.532 HG22 ' HB2' ' A' ' 32' ' ' LEU . 25.0 mt -98.58 125.98 51.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.241 -0.436 . . . . 74.44 111.108 179.969 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.762 HG22 HG22 ' A' ' 62' ' ' THR . 73.9 p -111.41 -178.51 3.47 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.188 -0.46 . . . . 72.31 111.1 -179.998 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.521 HG23 ' CD1' ' A' ' 52' ' ' ILE . 2.0 p -66.57 -26.76 67.27 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.214 -0.448 . . . . 71.24 111.147 -179.966 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 2.2 tppp? -75.07 -50.19 17.25 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.224 -0.444 . . . . 71.41 110.883 179.878 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 28.4 mt-10 -71.32 -40.38 70.8 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.266 -0.425 . . . . 74.15 110.843 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.532 ' HB2' HG22 ' A' ' 27' ' ' ILE . 3.9 tt -74.07 -49.19 25.18 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.199 -0.455 . . . . 61.23 110.921 -179.988 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -54.25 -27.94 41.13 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.771 -0.728 . . . . 73.01 112.453 179.93 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 95.1 m -68.97 -53.47 20.53 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.827 0.346 . . . . 75.14 111.095 -179.828 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.642 HG11 ' CE1' ' A' ' 19' ' ' PHE . 39.2 t -51.76 -51.42 27.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.223 -0.444 . . . . 60.41 111.172 179.89 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 7.5 mtt -54.21 -49.14 70.09 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.126 -0.488 . . . . 71.32 110.859 179.94 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 2.6 tmt_? -59.1 -42.6 90.87 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.205 -0.452 . . . . 62.21 110.887 -179.929 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' SER . . . . . 0.632 ' OG ' HD21 ' M' ' 41' ' ' LEU . 4.2 t -57.5 -29.9 64.68 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.14 -0.482 . . . . 72.41 110.859 -179.785 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.992 HD13 ' HB3' ' M' ' 37' ' ' ALA . 9.3 mt -91.91 -4.38 54.78 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.13 -0.486 . . . . 74.11 110.957 179.988 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 101.42 -13.15 58.4 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.738 -0.744 . . . . 73.15 112.523 179.943 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -81.48 96.27 7.35 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.855 0.359 . . . . 71.42 110.917 -179.883 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 6.4 t-20 -109.74 82.67 2.4 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.672 0.749 . . . . 62.21 110.874 -179.952 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.8 168.05 22.72 Favored 'Trans proline' 0 C--N 1.342 0.187 0 C-N-CA 122.719 2.279 . . . . 45.32 112.332 179.949 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 20.0 p -83.98 158.35 21.55 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.224 -0.443 . . . . 72.31 111.128 -179.947 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 15.1 mp0 -51.97 -48.36 64.38 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.228 -0.442 . . . . 60.0 110.914 179.98 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.78 -31.55 72.59 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.159 -0.473 . . . . 63.41 111.062 179.967 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -68.28 -52.0 38.73 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.259 -0.428 . . . . 74.44 110.915 -179.908 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 25.3 mt -55.09 -48.67 73.24 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.122 -0.49 . . . . 72.04 110.904 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 17.5 tp60 -54.4 -29.43 48.93 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.212 -0.449 . . . . 64.5 110.91 179.932 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' ASP . . . . . 0.73 ' OD2' HG21 ' A' ' 146' ' ' THR . 46.1 t0 -74.49 -29.53 61.46 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.189 -0.46 . . . . 73.42 110.862 179.989 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 51' ' ' MET . . . . . 0.619 ' HE2' HD13 ' M' ' 31' ' ' LEU . 41.5 mtp -73.14 -58.06 3.58 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.174 -0.467 . . . . 70.34 110.857 -179.974 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.521 ' CD1' HG23 ' A' ' 29' ' ' THR . 62.0 mt -53.32 -52.75 28.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.22 -0.446 . . . . 72.2 111.105 179.981 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 78.4 m-20 -57.0 -25.28 58.21 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.236 -0.438 . . . . 71.52 110.894 179.967 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -75.54 -28.33 59.02 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.145 -0.48 . . . . 63.24 110.87 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 9.8 m -109.81 10.87 8.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.164 -0.471 . . . . 60.53 111.104 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 28.8 t0 -86.69 99.99 12.15 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.199 -0.455 . . . . 62.04 110.869 179.89 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.3 -46.87 8.85 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.163 -0.471 . . . . 70.35 111.126 179.911 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 50.7 p30 -81.63 -0.3 41.84 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.226 -0.443 . . . . 71.34 110.88 -179.998 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 55.26 55.47 28.19 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.734 -0.746 . . . . 43.0 112.517 -179.916 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 50.3 p-10 -114.55 -15.76 11.97 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.863 0.363 . . . . 43.33 110.872 -179.858 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 89.39 20.46 44.98 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.705 -0.76 . . . . 64.33 112.527 -179.981 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' THR . . . . . 0.762 HG22 HG22 ' A' ' 28' ' ' THR . 71.4 p -150.49 161.1 43.18 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.723 0.296 . . . . 73.04 111.117 -179.814 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.429 HG21 ' HD1' ' A' ' 68' ' ' PHE . 22.9 mt -98.98 114.59 37.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.214 -0.448 . . . . 71.41 111.151 179.882 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.4 t0 -82.33 -172.84 4.22 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.213 -0.449 . . . . 74.44 110.86 179.902 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.529 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 2.4 t80 -65.1 -58.21 13.23 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.65 0.738 . . . . 65.14 110.867 -179.89 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 66' ' ' PRO . . . . . 0.529 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 53.9 Cg_endo -69.74 -24.26 29.98 Favored 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.674 2.25 . . . . 52.23 112.315 -179.968 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 75.9 mt-10 -65.29 -41.78 93.8 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.254 -0.43 . . . . 73.13 110.917 -179.964 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' PHE . . . . . 0.429 ' HD1' HG21 ' A' ' 63' ' ' ILE . 26.5 t80 -72.54 -36.11 68.19 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.148 -0.478 . . . . 63.52 110.863 -179.932 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 50.2 tp -68.98 -53.67 19.39 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.137 -0.483 . . . . 74.35 110.901 -179.973 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 13.3 t -58.44 -26.67 63.58 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.242 -0.436 . . . . 64.33 111.137 179.936 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 5.3 tmm? -62.25 -50.41 71.84 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.243 -0.435 . . . . 72.32 110.868 179.94 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 1.2 mmt -51.61 -45.39 63.2 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.215 -0.448 . . . . 74.22 110.88 179.951 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.313 0 CA-C-N 116.238 -0.437 . . . . 61.23 111.1 179.967 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.462 HG23 ' CE1' ' A' ' 141' ' ' PHE . 61.9 mt . . . . . 0 C--O 1.231 0.112 0 CA-C-O 120.85 0.357 . . . . 42.4 111.142 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 53.6 ttp180 -72.02 -32.92 67.63 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.193 -0.458 . . . . 74.13 110.871 179.975 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 24.9 mm-40 -76.56 -48.29 19.78 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.165 -0.471 . . . . 74.41 110.939 -179.975 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -53.37 -43.01 67.44 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.182 -0.463 . . . . 74.34 111.122 179.883 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.402 ' CD1' HD11 ' A' ' 100' ' ' ILE . 36.0 t80 -52.01 -37.28 52.76 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.244 -0.434 . . . . 71.11 110.875 -179.937 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 3.4 tmt_? -71.0 -38.67 72.66 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.128 -0.487 . . . . 74.33 110.845 -179.888 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 31.5 t -62.21 -48.13 89.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.196 -0.456 . . . . 75.42 111.13 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.496 ' CE1' HG11 ' A' ' 108' ' ' VAL . 9.9 m-85 -68.3 -26.3 65.57 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.186 -0.461 . . . . 73.15 110.875 -179.987 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 37.6 t0 -72.84 92.81 1.63 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.151 -0.477 . . . . 75.41 110.873 179.948 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 34.4 ttmt -78.57 -51.02 10.53 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.192 -0.458 . . . . 62.3 110.882 179.985 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 24.0 p30 -72.44 -9.1 58.11 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.228 -0.442 . . . . 61.33 110.866 179.87 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 60.0 29.37 67.86 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.779 -0.724 . . . . 70.12 112.482 -179.951 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 42.6 p-10 -82.98 -16.15 48.37 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.91 0.386 . . . . 73.43 110.908 -179.884 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 93.66 18.7 37.13 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.709 -0.757 . . . . 74.21 112.469 179.965 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 21.8 m-85 -139.26 165.56 26.86 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.884 0.373 . . . . 74.3 110.909 -179.799 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.402 HD11 ' CD1' ' A' ' 89' ' ' PHE . 77.5 mt -122.37 114.56 43.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.135 -0.484 . . . . 62.33 111.126 179.91 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 4.9 p -102.52 174.93 5.68 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.174 -0.466 . . . . 72.53 110.906 -179.927 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 102' ' ' ALA . . . . . 0.54 ' HB2' HG13 ' A' ' 125' ' ' ILE . . . -67.73 -30.2 69.62 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.191 -0.459 . . . . 61.01 111.124 179.889 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -68.13 -43.91 77.27 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.17 -0.468 . . . . 34.32 111.15 179.912 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 91.0 mt-10 -74.13 -47.68 34.52 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.193 -0.458 . . . . 71.44 110.875 -179.934 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 34.8 tp -53.86 -49.78 67.72 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.159 -0.473 . . . . 73.21 110.916 -179.944 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 106' ' ' ARG . . . . . 0.471 ' HB2' HG21 ' A' ' 121' ' ' VAL . 26.3 ttt180 -52.25 -41.62 62.96 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.191 -0.458 . . . . 52.41 110.876 179.923 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 27.3 t60 -59.74 -34.47 72.99 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.232 -0.44 . . . . 75.21 110.903 179.984 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.496 HG11 ' CE1' ' A' ' 92' ' ' PHE . 38.3 t -66.86 -45.71 86.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.193 -0.458 . . . . 53.14 111.153 179.956 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 109' ' ' MET . . . . . 0.471 ' HB3' HD12 ' A' ' 116' ' ' LEU . 3.4 mmt -60.59 -37.0 79.91 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.186 -0.461 . . . . 63.41 110.85 179.939 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 2.1 m -55.03 -34.33 63.41 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.236 -0.438 . . . . 71.04 111.152 -179.948 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 4.9 t-20 -70.96 -30.69 67.05 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.22 -0.446 . . . . 62.41 110.87 179.974 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.434 HD13 ' HE2' ' M' ' 18' ' ' LYS . 18.1 mt -73.01 -26.28 61.27 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.189 -0.46 . . . . 63.23 110.918 179.967 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 99.9 30.13 6.56 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.767 -0.73 . . . . 52.44 112.465 179.874 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -115.14 112.69 22.94 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.915 0.388 . . . . 62.31 110.87 -179.876 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.57 119.77 12.28 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.127 -0.488 . . . . 62.22 110.87 179.951 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.471 HD12 ' HB3' ' A' ' 109' ' ' MET . 7.8 mt -140.49 155.82 46.54 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.215 -0.448 . . . . 74.14 110.891 179.883 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 117' ' ' THR . . . . . 0.631 ' O ' HG23 ' A' ' 121' ' ' VAL . 52.5 p -115.03 170.54 8.27 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.181 -0.463 . . . . 74.11 111.141 179.958 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 20.6 m-20 -58.71 -33.21 69.94 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.215 -0.448 . . . . 75.41 110.857 179.909 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 22.5 tp10 -75.68 -33.46 60.39 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.184 -0.462 . . . . 72.34 110.865 -179.882 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 13.7 tt0 -71.15 -31.77 68.12 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.171 -0.468 . . . . 61.35 110.856 -179.914 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.631 HG23 ' O ' ' A' ' 117' ' ' THR . 43.5 t -71.27 -31.96 45.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.187 -0.461 . . . . 63.41 111.153 179.963 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 12.2 t0 -51.98 -46.86 65.02 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.137 -0.483 . . . . 65.34 110.811 179.954 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 20.6 tp10 -55.82 -29.33 59.6 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.214 -0.448 . . . . 71.51 110.877 -179.859 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 71.7 mtp -75.55 -59.48 2.73 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.144 -0.48 . . . . 73.04 110.903 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.54 HG13 ' HB2' ' A' ' 102' ' ' ALA . 35.9 mm -53.93 -35.7 28.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.243 -0.435 . . . . 61.33 111.165 179.898 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 56.8 ttt180 -63.49 -31.85 73.13 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.152 -0.476 . . . . 73.13 110.915 179.932 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -74.66 -52.37 11.83 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.139 -0.482 . . . . 74.33 110.864 -179.892 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.673 ' HB3' HG22 ' A' ' 136' ' ' VAL . . . -65.23 -34.49 78.48 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.102 -0.499 . . . . 55.43 111.099 179.925 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 49.4 t0 -68.45 86.74 0.3 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.26 -0.427 . . . . 70.43 110.864 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 55.2 mt -79.83 -46.13 22.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.166 -0.47 . . . . 72.14 111.141 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 21.3 p30 -72.8 -8.74 56.94 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.181 -0.463 . . . . 65.54 110.875 179.864 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 62.76 42.59 99.66 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.703 -0.761 . . . . 74.13 112.476 -179.917 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 34.6 p-10 -87.58 -16.0 35.8 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.864 0.364 . . . . 71.34 110.919 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 104.12 2.37 45.11 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.745 -0.741 . . . . 74.44 112.431 -179.988 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 4.0 tt0 -149.16 172.27 15.09 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.901 0.382 . . . . 73.41 110.894 -179.921 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 136' ' ' VAL . . . . . 0.673 HG22 ' HB3' ' A' ' 128' ' ' ALA . 99.3 t -107.33 111.25 34.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.21 -0.45 . . . . 51.22 111.127 179.98 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 19.0 p30 -92.11 165.59 13.08 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.15 -0.477 . . . . 74.15 110.881 -179.993 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 138' ' ' TYR . . . . . 0.43 ' O ' HG23 ' A' ' 142' ' ' VAL . 37.0 t80 -52.01 -46.89 65.15 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.162 -0.472 . . . . 64.33 110.983 -179.919 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 15.3 tt0 -51.94 -42.14 62.6 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.077 -0.51 . . . . 65.34 110.943 179.965 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 23.7 mt-10 -76.52 -34.27 58.58 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.108 -0.497 . . . . 71.41 110.92 -179.951 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 141' ' ' PHE . . . . . 0.462 ' CE1' HG23 ' A' ' 85' ' ' ILE . 43.2 t80 -65.74 -38.93 90.48 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.121 -0.49 . . . . 54.42 110.855 -179.897 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 142' ' ' VAL . . . . . 0.43 HG23 ' O ' ' A' ' 138' ' ' TYR . 98.9 t -71.34 -40.6 73.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.121 -0.491 . . . . 64.3 111.123 -179.989 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 24.4 tt0 -70.83 -45.31 64.78 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.173 -0.467 . . . . 61.1 110.911 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 11.4 tpt -65.0 -26.2 68.19 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.172 -0.467 . . . . 73.05 110.87 180.0 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 145' ' ' MET . . . . . 0.447 ' HE1' HG22 ' M' ' 19' ' ' ILE . 6.4 ttm -87.61 -39.47 15.04 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.25 -0.432 . . . . 64.53 110.887 179.916 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 146' ' ' THR . . . . . 0.73 HG21 ' OD2' ' A' ' 50' ' ' ASP . 2.6 m . . . . . 0 C--N 1.329 -0.286 0 CA-C-N 116.197 -0.456 . . . . 72.43 111.113 -179.87 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' M' M ' 15' ' ' LYS . . . . . . . . . . . . . 44.7 mttp . . . . . 0 C--O 1.231 0.112 0 CA-C-O 120.779 0.323 . . . . 62.45 110.888 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' M' M ' 16' ' ' TRP . . . . . . . . . . . . . 10.2 m95 -54.09 -39.03 65.96 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.241 -0.436 . . . . 71.02 110.919 179.923 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' M' M ' 17' ' ' GLU . . . . . . . . . . . . . 15.3 tm-20 -56.9 -27.8 61.15 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.227 -0.442 . . . . 74.42 110.872 -179.929 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' M' M ' 18' ' ' LYS . . . . . 0.434 ' HE2' HD13 ' A' ' 112' ' ' LEU . 6.9 ttpm? -73.45 -26.95 61.16 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.153 -0.476 . . . . 62.1 110.913 179.953 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' M' M ' 19' ' ' ILE . . . . . 0.447 HG22 ' HE1' ' A' ' 145' ' ' MET . 27.6 mt -93.02 -23.45 5.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.25 -0.432 . . . . 64.3 111.169 179.848 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' M' M ' 20' ' ' ARG . . . . . . . . . . . . . 25.5 ttp85 . . . . . 0 C--N 1.329 -0.284 0 CA-C-N 116.193 -0.458 . . . . 74.11 110.846 179.972 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' M' M ' 30' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.232 0.181 0 CA-C-O 120.798 0.332 . . . . 74.14 110.896 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' M' M ' 31' ' ' LEU . . . . . 0.619 HD13 ' HE2' ' A' ' 51' ' ' MET . 10.9 tp -147.95 -46.56 0.16 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.253 -0.431 . . . . 70.41 110.898 179.984 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' M' M ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.45 -32.83 8.31 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.169 -0.469 . . . . 64.43 110.919 179.866 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' M' M ' 33' ' ' HIS . . . . . . . . . . . . . 77.6 t60 -47.99 -47.17 33.23 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.226 -0.443 . . . . 72.41 110.846 179.919 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' M' M ' 34' ' ' ILE . . . . . 0.501 ' H ' HD12 ' M' ' 34' ' ' ILE . 3.6 mp -51.73 -38.75 22.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.169 -0.469 . . . . 71.43 111.137 179.967 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' M' M ' 35' ' ' VAL . . . . . . . . . . . . . 47.1 t -49.01 -39.63 12.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.203 -0.453 . . . . 74.2 111.138 179.826 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' M' M ' 36' ' ' TRP . . . . . . . . . . . . . 20.9 m0 -59.19 -40.21 85.03 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.197 -0.456 . . . . 73.31 110.923 179.972 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' M' M ' 37' ' ' ALA . . . . . 0.992 ' HB3' HD13 ' A' ' 39' ' ' LEU . . . -63.01 -18.77 63.68 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.231 -0.44 . . . . 51.41 111.09 179.912 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' M' M ' 38' ' ' SER . . . . . . . . . . . . . 5.0 m -64.92 -17.8 64.66 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.207 -0.451 . . . . 64.13 110.886 -179.803 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' M' M ' 39' ' ' ARG . . . . . . . . . . . . . 52.3 mtp180 -52.12 -29.2 20.77 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.123 -0.49 . . . . 70.04 110.88 -179.931 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' M' M ' 40' ' ' GLU . . . . . . . . . . . . . 17.7 tp10 -90.05 -48.08 7.42 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.205 -0.452 . . . . 71.3 110.887 -179.955 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' M' M ' 41' ' ' LEU . . . . . 0.632 HD21 ' OG ' ' A' ' 38' ' ' SER . 6.8 mt . . . . . 0 C--N 1.328 -0.333 0 CA-C-N 116.132 -0.485 . . . . 74.3 110.9 -179.958 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 32.4 tt0 . . . . . 0 C--O 1.231 0.094 0 CA-C-O 120.803 0.335 . . . . 74.03 110.921 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 54.3 mt -72.69 -45.8 56.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.184 -0.462 . . . . 73.24 111.105 179.962 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -52.0 -29.54 21.26 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.23 -0.441 . . . . 74.04 111.087 179.818 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 41.3 tp10 -73.87 -38.39 64.45 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.263 -0.426 . . . . 72.41 110.93 -179.958 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 30.3 m-85 -75.82 -46.02 32.76 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.108 -0.496 . . . . 73.14 110.854 -179.933 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 35.1 ttmt -60.63 -35.47 76.26 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.175 -0.466 . . . . 72.31 110.955 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 23.0 mt-10 -58.62 -37.73 76.51 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.228 -0.442 . . . . 75.4 110.911 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.418 ' HB1' HG13 ' M' ' 35' ' ' VAL . . . -71.43 -43.94 65.79 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.126 -0.488 . . . . 70.43 111.096 179.913 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 92.6 t80 -55.49 -53.97 49.76 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.254 -0.43 . . . . 72.5 110.868 -179.912 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 12.6 t -52.43 -30.41 29.34 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.177 -0.465 . . . . 72.41 110.887 -179.799 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.627 HD23 ' HB3' ' M' ' 38' ' ' SER . 15.6 tp -65.71 -42.19 91.43 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.099 -0.5 . . . . 54.45 110.878 -179.968 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 43.1 m-85 -75.43 -25.46 57.51 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.181 -0.463 . . . . 70.0 110.866 179.948 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 20.9 t0 -84.02 98.54 9.89 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.167 -0.469 . . . . 64.14 110.85 179.994 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 15.7 ttmm -71.11 -55.51 8.04 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.167 -0.47 . . . . 71.01 110.906 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 22.5 p-10 -72.19 -10.15 59.4 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.225 -0.443 . . . . 74.12 110.833 179.909 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 51.82 42.14 52.53 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.777 -0.725 . . . . 74.51 112.506 -179.9 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 27.5 p-10 -88.44 -15.8 34.48 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.824 0.345 . . . . 73.34 110.814 -179.967 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 104.98 -7.14 44.17 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.776 -0.726 . . . . 72.5 112.496 -179.907 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 2.8 p -131.79 130.83 42.34 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.737 0.304 . . . . 75.23 111.168 -179.862 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.58 HG21 HD23 ' A' ' 32' ' ' LEU . 28.7 mt -93.69 120.32 42.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.191 -0.459 . . . . 72.2 111.143 179.91 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.601 HG22 ' CG2' ' A' ' 62' ' ' THR . 20.3 p -101.43 175.46 5.56 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.164 -0.471 . . . . 72.02 111.146 179.948 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 33.7 p -62.36 -24.97 67.66 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.185 -0.461 . . . . 74.4 111.146 -179.97 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 31.3 mttm -73.09 -50.1 24.78 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.215 -0.448 . . . . 72.55 110.898 179.901 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.554 ' O ' HG23 ' A' ' 35' ' ' VAL . 46.2 mt-10 -73.74 -32.69 63.98 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.255 -0.43 . . . . 74.53 110.883 179.975 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.581 HD13 ' O ' ' A' ' 32' ' ' LEU . 0.9 OUTLIER -73.51 -40.87 63.71 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.16 -0.473 . . . . 72.15 110.919 179.99 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -71.73 -40.52 58.3 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.736 -0.745 . . . . 64.25 112.51 179.923 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 96.7 m -59.6 -56.09 26.24 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.825 0.345 . . . . 75.12 111.107 -179.852 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.554 HG23 ' O ' ' A' ' 31' ' ' GLU . 97.4 t -51.44 -50.11 29.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.247 -0.433 . . . . 72.52 111.139 179.908 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 3.0 mtp -52.07 -32.1 33.22 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.125 -0.489 . . . . 74.3 110.901 179.918 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 40.8 ttt-85 -64.4 -48.23 76.19 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.207 -0.451 . . . . 63.53 110.868 -179.919 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' SER . . . . . 0.688 ' OG ' HD11 ' M' ' 41' ' ' LEU . 2.2 p -59.42 -28.81 67.27 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.176 -0.466 . . . . 15.35 110.834 -179.775 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 1.029 HD13 ' HB3' ' M' ' 37' ' ' ALA . 32.8 mt -80.32 -16.27 54.98 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.183 -0.462 . . . . 73.24 110.928 179.994 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 101.58 27.11 7.31 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.721 -0.752 . . . . 62.43 112.487 179.927 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 5.2 mt-30 -119.69 135.42 54.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.802 0.334 . . . . 62.5 110.894 -179.845 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 32.5 t-20 -109.79 76.76 0.97 Allowed Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 121.627 0.727 . . . . 63.32 110.914 -179.949 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.75 149.73 67.35 Favored 'Trans proline' 0 C--O 1.232 0.191 0 C-N-CA 122.634 2.223 . . . . 63.41 112.375 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 20.9 p -99.15 176.77 5.43 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.23 -0.441 . . . . 74.54 111.109 -179.925 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 36.1 mm-40 -64.83 -47.02 79.47 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.185 -0.461 . . . . 74.44 110.949 179.94 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.4 -38.94 65.43 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.158 -0.474 . . . . 71.43 111.047 179.94 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 13.2 tt0 -55.8 -52.65 63.24 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.267 -0.424 . . . . 75.02 110.896 -179.916 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.457 ' CD2' HD12 ' A' ' 32' ' ' LEU . 9.2 mt -57.59 -52.19 66.43 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.15 -0.477 . . . . 63.54 110.948 179.985 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.2 mm-40 -56.97 -28.5 62.36 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.21 -0.45 . . . . 72.12 110.88 179.933 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -63.98 -49.57 71.97 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.199 -0.455 . . . . 63.01 110.881 179.998 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' MET . . . . . 0.64 ' SD ' HD13 ' M' ' 31' ' ' LEU . 6.7 ptp -75.71 -37.49 59.4 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.233 -0.439 . . . . 74.41 110.878 179.985 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 79.2 mt -65.31 -47.49 86.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.23 -0.441 . . . . 72.44 111.138 179.984 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 85.2 m-20 -58.39 -33.58 69.78 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.147 -0.479 . . . . 73.34 110.895 179.921 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 15.0 mm-40 -62.41 -51.02 69.2 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.178 -0.464 . . . . 73.13 110.901 -179.997 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 17.6 m -77.98 -15.0 14.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.125 -0.489 . . . . 62.24 111.143 179.97 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 39.1 t0 -66.75 95.19 0.34 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.172 -0.467 . . . . 64.53 110.89 179.877 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.26 -35.3 17.36 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.166 -0.47 . . . . 73.43 111.101 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -88.22 -0.13 56.76 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.199 -0.455 . . . . 70.01 110.852 -179.998 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 52.79 58.95 9.99 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.726 -0.749 . . . . 35.25 112.495 -179.954 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 51.8 p-10 -114.63 -15.78 11.92 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.836 0.351 . . . . 64.15 110.888 -179.899 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 93.25 18.54 38.91 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.755 -0.736 . . . . 74.3 112.471 179.961 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' THR . . . . . 0.601 ' CG2' HG22 ' A' ' 28' ' ' THR . 63.9 p -150.76 170.77 18.44 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.754 0.312 . . . . 73.43 111.153 -179.855 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 21.5 mt -102.47 109.53 26.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.257 -0.429 . . . . 74.31 111.132 179.942 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -74.13 -172.86 1.48 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.18 -0.464 . . . . 73.3 110.869 179.866 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.54 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 2.5 t80 -65.38 -58.05 13.16 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.647 0.737 . . . . 73.25 110.908 -179.923 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 66' ' ' PRO . . . . . 0.54 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 53.2 Cg_endo -69.75 -25.92 28.14 Favored 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.725 2.283 . . . . 65.44 112.317 -179.97 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -63.23 -39.98 96.17 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.211 -0.45 . . . . 74.15 110.879 -179.956 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 44.9 t80 -74.5 -35.94 63.23 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.132 -0.485 . . . . 74.42 110.883 -179.909 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 21.9 tp -71.03 -54.14 12.24 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.183 -0.462 . . . . 72.42 110.879 -179.978 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 13.4 t -51.69 -30.01 20.45 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.202 -0.453 . . . . 61.03 111.168 179.904 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 37.7 ttp -59.72 -41.95 91.99 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.205 -0.452 . . . . 64.52 110.842 179.975 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 3.5 mtt -79.84 -28.87 40.03 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.228 -0.442 . . . . 73.33 110.865 179.952 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.28 0 CA-C-N 116.273 -0.421 . . . . 63.53 111.111 179.908 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.596 HG21 HG22 ' A' ' 142' ' ' VAL . 5.0 mp . . . . . 0 C--O 1.231 0.106 0 CA-C-O 120.807 0.337 . . . . 73.31 111.117 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 20.4 ttt-85 -61.68 -28.23 69.25 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.188 -0.46 . . . . 65.41 110.865 -179.992 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.672 ' O ' HG23 ' A' ' 91' ' ' VAL . 7.9 mm-40 -68.19 -48.33 65.54 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.193 -0.458 . . . . 75.32 110.932 -179.997 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 88' ' ' ALA . . . . . 0.75 ' HB1' ' CE2' ' A' ' 92' ' ' PHE . . . -74.04 -35.34 64.31 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.149 -0.478 . . . . 70.25 111.069 179.96 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 4.4 t80 -53.71 -47.78 70.2 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.256 -0.429 . . . . 75.13 110.863 -179.897 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 7.5 ptm180 -69.04 -25.95 64.73 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.131 -0.486 . . . . 73.43 110.875 -179.926 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 91' ' ' VAL . . . . . 0.672 HG23 ' O ' ' A' ' 87' ' ' GLU . 96.5 t -78.12 -27.4 14.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.194 -0.457 . . . . 74.5 111.131 179.988 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.75 ' CE2' ' HB1' ' A' ' 88' ' ' ALA . 21.9 m-85 -94.66 -26.14 16.45 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.134 -0.485 . . . . 72.51 110.888 -179.992 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 32.7 t0 -73.98 95.1 2.44 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.161 -0.472 . . . . 72.14 110.866 179.982 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 42.9 mmtt -78.68 -52.54 8.27 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.199 -0.455 . . . . 63.25 110.886 -180.0 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 52.1 p-10 -72.44 -9.15 58.17 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.211 -0.449 . . . . 64.45 110.838 179.917 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 59.79 28.37 65.59 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.709 -0.758 . . . . 73.3 112.487 -179.934 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 35.4 p-10 -81.77 -16.14 51.98 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.857 0.36 . . . . 50.23 110.881 -179.897 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 88.73 18.68 54.11 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.717 -0.754 . . . . 73.45 112.543 -179.952 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 23.6 m-85 -142.83 153.64 43.4 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.898 0.38 . . . . 72.13 110.918 -179.824 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.488 HD12 ' HD2' ' A' ' 141' ' ' PHE . 78.1 mt -119.25 127.04 75.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.089 -0.505 . . . . 72.22 111.133 179.954 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 6.4 p -112.44 -176.19 2.86 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.184 -0.462 . . . . 40.22 110.882 -179.946 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 102' ' ' ALA . . . . . 0.55 ' HB2' HG13 ' A' ' 125' ' ' ILE . . . -74.31 -27.49 60.73 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.149 -0.478 . . . . 72.34 111.144 179.9 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -72.01 -47.68 50.1 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.21 -0.45 . . . . 71.34 111.09 179.951 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -67.78 -46.07 73.02 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.209 -0.45 . . . . 70.41 110.897 -179.922 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.65 HD21 ' HE2' ' A' ' 124' ' ' MET . 21.2 tp -52.87 -39.56 62.74 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.109 -0.496 . . . . 75.53 110.936 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 106' ' ' ARG . . . . . 0.443 ' O ' HG23 ' A' ' 110' ' ' THR . 63.0 ttp85 -55.46 -38.7 69.41 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.177 -0.465 . . . . 74.32 110.874 179.939 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 40.8 t60 -66.83 -34.37 77.67 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.171 -0.468 . . . . 72.15 110.862 -179.989 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 88.6 t -72.0 -51.18 32.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.21 -0.45 . . . . 74.2 111.132 179.955 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 1.3 mmt -60.61 -43.72 97.12 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.184 -0.462 . . . . 75.24 110.869 179.929 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 110' ' ' THR . . . . . 0.443 HG23 ' O ' ' A' ' 106' ' ' ARG . 9.7 p -54.03 -27.26 31.02 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.235 -0.439 . . . . 74.25 111.137 -179.929 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.9 t30 -70.78 -31.68 68.54 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.223 -0.444 . . . . 62.33 110.885 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.608 HD13 ' HE2' ' M' ' 18' ' ' LYS . 8.2 mt -71.19 -26.21 62.86 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.201 -0.454 . . . . 60.02 110.89 179.967 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 100.89 32.62 5.29 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.752 -0.737 . . . . 71.3 112.5 179.902 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 13.8 mm-40 -113.78 119.98 39.2 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.908 0.385 . . . . 73.1 110.896 -179.88 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 115' ' ' LYS . . . . . 0.466 ' O ' HD23 ' A' ' 116' ' ' LEU . 7.7 tptm -68.89 97.95 0.89 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.125 -0.488 . . . . 72.32 110.902 179.973 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.59 HD22 ' HG2' ' A' ' 120' ' ' GLU . 16.4 mt -133.01 119.41 20.03 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.244 -0.434 . . . . 73.22 110.896 179.929 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 117' ' ' THR . . . . . 0.415 ' O ' HG23 ' A' ' 121' ' ' VAL . 82.2 p -84.22 174.31 10.3 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.183 -0.462 . . . . 62.32 111.126 179.966 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -52.68 -42.93 65.22 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.23 -0.441 . . . . 70.51 110.884 179.881 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -62.29 -33.39 74.56 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.194 -0.457 . . . . 63.34 110.862 -179.882 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 120' ' ' GLU . . . . . 0.59 ' HG2' HD22 ' A' ' 116' ' ' LEU . 6.2 tp10 -70.84 -39.42 72.97 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.151 -0.477 . . . . 74.01 110.867 -179.91 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.474 HG11 ' O ' ' A' ' 102' ' ' ALA . 21.9 t -65.25 -31.27 53.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.173 -0.467 . . . . 74.24 111.143 179.958 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 20.0 t0 -51.95 -46.11 64.62 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.133 -0.485 . . . . 73.43 110.905 179.919 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 13.3 tp10 -56.57 -29.6 62.21 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.198 -0.455 . . . . 73.4 110.878 -179.947 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 124' ' ' MET . . . . . 0.65 ' HE2' HD21 ' A' ' 105' ' ' LEU . 55.7 mtp -75.42 -59.51 2.72 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.171 -0.468 . . . . 73.32 110.913 179.957 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.55 HG13 ' HB2' ' A' ' 102' ' ' ALA . 35.9 mm -53.95 -35.69 28.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.216 -0.447 . . . . 75.11 111.119 179.948 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 1.6 tmt_? -63.33 -31.9 73.17 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.137 -0.483 . . . . 75.42 110.904 179.939 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -74.8 -52.39 11.58 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.203 -0.453 . . . . 64.25 110.887 -179.947 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.652 ' HB3' HG22 ' A' ' 136' ' ' VAL . . . -65.13 -34.44 78.4 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.19 -0.459 . . . . 62.31 111.081 179.957 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 49.3 t0 -68.38 86.73 0.29 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.247 -0.433 . . . . 74.05 110.853 179.981 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 61.1 mt -79.86 -46.21 22.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.228 -0.442 . . . . 73.45 111.17 179.982 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 21.2 p30 -72.8 -8.67 56.6 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.173 -0.467 . . . . 73.53 110.862 179.815 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 62.81 43.05 99.52 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.751 -0.737 . . . . 63.11 112.488 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 34.5 p-10 -88.3 -15.93 34.43 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.847 0.356 . . . . 71.33 110.907 -179.991 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 103.91 2.45 45.81 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.701 -0.761 . . . . 42.25 112.491 -179.957 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 4.1 tt0 -149.19 172.26 15.11 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.816 0.341 . . . . 72.44 110.894 -179.862 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 136' ' ' VAL . . . . . 0.652 HG22 ' HB3' ' A' ' 128' ' ' ALA . 86.5 t -107.84 111.91 37.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.192 -0.458 . . . . 71.11 111.135 179.939 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 43.6 p-10 -92.52 166.61 12.43 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.183 -0.462 . . . . 65.43 110.908 179.97 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 138' ' ' TYR . . . . . 0.511 ' O ' HG23 ' A' ' 142' ' ' VAL . 52.1 t80 -51.98 -46.79 64.98 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.169 -0.469 . . . . 74.44 110.949 -179.948 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -52.01 -43.77 63.82 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.116 -0.493 . . . . 75.53 110.847 -179.947 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 24.1 mt-10 -75.11 -31.86 61.24 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.204 -0.453 . . . . 62.51 110.877 -179.911 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 141' ' ' PHE . . . . . 0.589 ' CD1' HG23 ' A' ' 85' ' ' ILE . 6.2 t80 -68.07 -35.35 78.06 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.114 -0.494 . . . . 75.41 110.902 -179.895 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 142' ' ' VAL . . . . . 0.596 HG22 HG21 ' A' ' 85' ' ' ILE . 92.7 t -71.23 -42.14 74.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.161 -0.472 . . . . 75.0 111.15 179.932 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 18.4 tt0 -71.07 -28.55 64.43 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.156 -0.475 . . . . 62.55 110.89 -179.993 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 6.2 tpt -74.0 -55.24 6.38 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.211 -0.449 . . . . 75.01 110.911 179.927 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 11.9 ttm -66.09 -33.87 76.77 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.219 -0.446 . . . . 75.31 110.912 179.927 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 2.0 m . . . . . 0 C--N 1.33 -0.278 0 CA-C-N 116.235 -0.439 . . . . 61.11 111.177 -179.961 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' M' M ' 15' ' ' LYS . . . . . . . . . . . . . 7.4 mtmp? . . . . . 0 C--O 1.231 0.098 0 CA-C-O 120.787 0.327 . . . . 71.3 110.881 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' M' M ' 16' ' ' TRP . . . . . 0.5 ' CE3' HD12 ' M' ' 19' ' ' ILE . 19.2 m95 -51.99 -38.95 58.53 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.184 -0.462 . . . . 71.53 110.978 179.917 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' M' M ' 17' ' ' GLU . . . . . . . . . . . . . 30.9 tp10 -56.17 -32.21 64.12 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.205 -0.452 . . . . 75.14 110.833 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' M' M ' 18' ' ' LYS . . . . . 0.608 ' HE2' HD13 ' A' ' 112' ' ' LEU . 6.4 ttpm? -63.36 -29.22 70.56 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.178 -0.464 . . . . 74.54 110.923 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' M' M ' 19' ' ' ILE . . . . . 0.5 HD12 ' CE3' ' M' ' 16' ' ' TRP . 28.8 mt -86.48 -25.13 6.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.192 -0.458 . . . . 53.51 111.166 179.86 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' M' M ' 20' ' ' ARG . . . . . . . . . . . . . 22.6 ttp180 . . . . . 0 C--N 1.33 -0.261 0 CA-C-N 116.17 -0.468 . . . . 75.15 110.863 179.984 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' M' M ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.146 0 CA-C-O 120.775 0.321 . . . . 74.51 110.889 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' M' M ' 31' ' ' LEU . . . . . 0.64 HD13 ' SD ' ' A' ' 51' ' ' MET . 13.7 tp -137.25 -51.39 0.65 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.196 -0.456 . . . . 53.21 110.911 179.924 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' M' M ' 32' ' ' LYS . . . . . . . . . . . . . 3.0 ptpp? -49.55 -39.14 33.74 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.219 -0.446 . . . . 72.54 110.901 179.81 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' M' M ' 33' ' ' HIS . . . . . . . . . . . . . 10.7 t-160 -50.09 -41.26 47.92 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.227 -0.442 . . . . 73.13 110.861 179.925 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' M' M ' 34' ' ' ILE . . . . . 0.444 HD12 HD12 ' M' ' 31' ' ' LEU . 65.0 mt -50.37 -39.32 16.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.19 -0.459 . . . . 63.32 111.148 179.989 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' M' M ' 35' ' ' VAL . . . . . 0.418 HG13 ' HB1' ' A' ' 15' ' ' ALA . 61.5 t -49.16 -40.28 13.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.192 -0.458 . . . . 73.55 111.121 179.824 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' M' M ' 36' ' ' TRP . . . . . . . . . . . . . 21.7 m0 -58.93 -39.52 81.83 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.122 -0.49 . . . . 74.42 110.927 179.985 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' M' M ' 37' ' ' ALA . . . . . 1.029 ' HB3' HD13 ' A' ' 39' ' ' LEU . . . -64.13 -18.61 64.59 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.218 -0.446 . . . . 34.21 111.117 179.869 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' M' M ' 38' ' ' SER . . . . . 0.627 ' HB3' HD23 ' A' ' 18' ' ' LEU . 0.8 OUTLIER -72.18 -17.98 61.9 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.237 -0.438 . . . . 74.15 110.872 -179.8 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' M' M ' 39' ' ' ARG . . . . . . . . . . . . . 4.6 tpt85 -60.75 -25.47 66.51 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.116 -0.493 . . . . 62.42 110.896 -179.914 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' M' M ' 40' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 -78.04 -47.99 17.12 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.131 -0.486 . . . . 62.21 110.874 -179.9 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' M' M ' 41' ' ' LEU . . . . . 0.688 HD11 ' OG ' ' A' ' 38' ' ' SER . 17.3 mt . . . . . 0 C--N 1.329 -0.309 0 CA-C-N 116.163 -0.471 . . . . 73.12 110.93 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 19.4 tt0 . . . . . 0 C--O 1.231 0.113 0 CA-C-O 120.772 0.32 . . . . 72.31 110.936 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 61.7 mt -68.78 -37.3 77.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.192 -0.458 . . . . 55.33 111.115 179.991 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -52.33 -49.85 63.45 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.166 -0.47 . . . . 55.21 111.082 179.852 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 17.0 mm-40 -54.92 -39.91 69.3 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.222 -0.445 . . . . 75.22 110.903 -179.916 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 31.4 m-85 -72.68 -41.2 65.59 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.148 -0.478 . . . . 72.21 110.852 -179.921 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 18.4 ttpp -54.81 -41.69 70.94 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.167 -0.47 . . . . 71.21 110.88 -179.99 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 8.4 tt0 -59.11 -36.12 74.63 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.228 -0.442 . . . . 70.44 110.884 179.948 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -67.91 -49.69 60.44 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.147 -0.478 . . . . 44.23 111.089 179.957 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 57.8 t80 -52.15 -49.52 63.59 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.226 -0.443 . . . . 74.14 110.913 -179.904 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 12.9 t -57.14 -30.39 64.39 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.151 -0.477 . . . . 63.13 110.893 -179.81 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.477 HD23 ' HB3' ' M' ' 38' ' ' SER . 15.7 tp -66.06 -42.2 89.78 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.068 -0.514 . . . . 74.14 110.885 179.984 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.613 ' HA ' HG21 ' A' ' 35' ' ' VAL . 67.6 m-85 -78.02 -24.92 47.72 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.222 -0.445 . . . . 74.31 110.866 179.94 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 14.3 t0 -79.14 98.61 6.63 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.178 -0.464 . . . . 75.43 110.866 179.975 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.448 ' NZ ' HG21 ' A' ' 34' ' ' THR . 9.2 ttmm -66.49 -50.28 63.79 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.201 -0.454 . . . . 63.32 110.895 179.995 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 18.5 p-10 -81.46 -10.09 59.57 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.219 -0.446 . . . . 71.03 110.831 179.908 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 52.04 55.64 20.38 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.73 -0.748 . . . . 24.04 112.508 -179.889 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 29.2 p-10 -111.56 17.74 19.73 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.798 0.332 . . . . 70.22 110.849 -179.968 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 71.68 18.25 77.17 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.753 -0.737 . . . . 43.11 112.529 -179.907 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 22.3 p -145.46 156.53 43.8 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.714 0.292 . . . . 73.51 111.155 -179.85 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.413 HG22 ' HB2' ' A' ' 32' ' ' LEU . 28.8 mt -130.27 125.47 59.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.233 -0.44 . . . . 74.03 111.193 179.924 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.6 HG22 HG21 ' A' ' 62' ' ' THR . 80.9 p -110.53 177.14 4.78 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.206 -0.452 . . . . 70.11 111.168 179.998 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 49.5 p -63.54 -25.47 68.26 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.22 -0.445 . . . . 74.43 111.115 -179.962 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 2.3 tppt? -79.96 -50.17 10.82 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.174 -0.466 . . . . 75.15 110.868 179.94 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 -67.89 -36.97 81.15 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.207 -0.451 . . . . 75.53 110.867 179.996 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.413 ' HB2' HG22 ' A' ' 27' ' ' ILE . 4.1 tt -73.83 -53.58 9.92 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.157 -0.474 . . . . 61.12 110.957 -179.973 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -51.92 -28.4 24.3 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.743 -0.741 . . . . 61.14 112.524 179.83 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.448 HG21 ' NZ ' ' A' ' 21' ' ' LYS . 97.6 m -63.18 -58.99 5.37 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.883 0.373 . . . . 64.22 111.172 -179.866 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.613 HG21 ' HA ' ' A' ' 19' ' ' PHE . 51.6 t -57.72 -34.57 48.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.173 -0.467 . . . . 72.31 111.141 179.891 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 6.3 mmm -59.62 -49.01 79.41 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.158 -0.474 . . . . 73.33 110.874 179.968 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 29.7 ttp180 -57.17 -42.65 81.52 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.236 -0.438 . . . . 75.42 110.872 -179.945 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' SER . . . . . 0.419 ' OG ' HD21 ' M' ' 41' ' ' LEU . 1.6 t -57.91 -25.28 60.64 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.202 -0.454 . . . . 62.51 110.883 -179.814 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.891 HD13 ' HB3' ' M' ' 37' ' ' ALA . 83.3 mt -94.41 -10.39 32.64 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.084 -0.507 . . . . 70.44 110.876 -179.98 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 101.54 -6.63 55.4 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.76 -0.733 . . . . 44.32 112.468 179.93 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 15.8 tp60 -87.39 102.34 14.44 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.833 0.349 . . . . 75.1 110.9 -179.853 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 6.1 t-20 -109.85 76.75 0.98 Allowed Pre-proline 0 C--N 1.33 -0.279 0 CA-C-O 121.574 0.702 . . . . 65.34 110.887 -179.971 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.79 168.0 22.86 Favored 'Trans proline' 0 C--O 1.232 0.187 0 C-N-CA 122.709 2.273 . . . . 71.44 112.351 179.937 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 79.0 p -84.68 161.78 19.94 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.237 -0.438 . . . . 51.24 111.118 -179.949 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 94.1 mt-10 -52.41 -38.9 60.14 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.17 -0.468 . . . . 64.21 110.862 179.983 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.32 -39.28 65.39 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.183 -0.462 . . . . 42.53 111.051 179.957 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -62.09 -47.55 84.13 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.232 -0.44 . . . . 63.24 110.906 -179.923 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 22.0 mt -55.43 -47.48 75.91 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.159 -0.473 . . . . 71.31 110.894 -179.984 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 37.1 tp60 -71.86 -28.1 63.32 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.216 -0.447 . . . . 44.2 110.897 179.938 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -56.21 -49.77 73.14 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.218 -0.446 . . . . 63.33 110.888 179.904 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 6.0 ptp -69.85 -36.28 75.41 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.191 -0.459 . . . . 62.43 110.894 -179.986 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 87.3 mt -63.78 -41.35 92.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.249 -0.432 . . . . 73.31 111.153 179.922 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 34.5 m-20 -70.38 -31.7 69.05 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.18 -0.464 . . . . 73.23 110.907 179.935 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -71.62 -25.09 62.01 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.142 -0.481 . . . . 64.33 110.851 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.488 HG11 ' SD ' ' A' ' 71' ' ' MET . 29.1 m -106.65 7.2 9.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.196 -0.456 . . . . 52.32 111.119 179.98 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -82.62 99.77 9.77 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.192 -0.458 . . . . 73.21 110.843 179.961 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.4 -33.85 17.76 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.148 -0.478 . . . . 72.2 111.147 179.932 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 2.6 p-10 -92.52 -0.57 57.32 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.199 -0.455 . . . . 75.23 110.869 179.945 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 50.85 60.94 6.5 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.744 -0.741 . . . . 72.11 112.517 -179.899 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 50.9 p-10 -114.55 -15.78 11.97 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.915 0.388 . . . . 61.24 110.901 -179.873 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 95.43 15.71 42.87 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.726 -0.75 . . . . 62.34 112.503 179.963 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' THR . . . . . 0.6 HG21 HG22 ' A' ' 28' ' ' THR . 22.5 p -152.68 175.45 12.81 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.795 0.331 . . . . 71.24 111.157 -179.922 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.57 HG21 ' HD1' ' A' ' 68' ' ' PHE . 27.0 mt -106.83 111.57 36.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.213 -0.449 . . . . 71.32 111.13 179.912 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -77.93 -172.78 2.83 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.158 -0.474 . . . . 72.02 110.856 179.89 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.538 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 2.4 t80 -64.93 -57.94 14.38 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.604 0.716 . . . . 73.14 110.9 -179.895 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 66' ' ' PRO . . . . . 0.538 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 53.8 Cg_endo -69.78 -28.74 24.76 Favored 'Trans proline' 0 C--N 1.341 0.159 0 C-N-CA 122.677 2.251 . . . . 73.43 112.353 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 18.2 mt-10 -60.97 -39.73 90.72 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.188 -0.46 . . . . 72.15 110.875 -179.984 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' PHE . . . . . 0.57 ' HD1' HG21 ' A' ' 63' ' ' ILE . 20.1 t80 -74.3 -36.23 63.72 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.094 -0.503 . . . . 75.33 110.848 -179.864 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 27.7 tp -69.53 -53.82 17.15 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.191 -0.459 . . . . 74.53 110.913 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 14.7 t -53.08 -27.95 22.74 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.193 -0.458 . . . . 61.23 111.134 179.934 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' MET . . . . . 0.488 ' SD ' HG11 ' A' ' 55' ' ' VAL . 42.6 ttp -64.4 -49.9 69.72 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.27 -0.423 . . . . 63.45 110.856 179.914 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 72' ' ' MET . . . . . 0.414 ' HE3' HG11 ' M' ' 35' ' ' VAL . 1.2 mtt -53.33 -44.15 68.24 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.244 -0.435 . . . . 52.32 110.849 179.998 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.301 0 CA-C-N 116.229 -0.441 . . . . 61.33 111.109 179.933 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.639 HG21 HG13 ' A' ' 142' ' ' VAL . 62.1 mt . . . . . 0 C--O 1.231 0.123 0 CA-C-O 120.784 0.326 . . . . 75.22 111.161 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 44.8 ttp85 -68.82 -52.25 32.07 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.164 -0.471 . . . . 73.44 110.845 179.977 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.733 ' O ' HG23 ' A' ' 91' ' ' VAL . 16.0 tp10 -54.54 -53.48 53.9 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.24 -0.436 . . . . 74.25 110.908 -179.937 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -53.36 -50.74 64.43 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.127 -0.488 . . . . 74.34 111.12 179.911 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 5.9 t80 -52.12 -51.28 58.84 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.22 -0.445 . . . . 74.33 110.899 -179.957 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 60.0 ttt-85 -59.93 -45.05 93.84 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.199 -0.455 . . . . 65.14 110.873 -179.93 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 91' ' ' VAL . . . . . 0.733 HG23 ' O ' ' A' ' 87' ' ' GLU . 91.6 t -53.94 -45.47 63.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.211 -0.45 . . . . 72.32 111.172 179.954 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 10.7 m-85 -76.39 -26.35 55.49 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.167 -0.47 . . . . 73.54 110.873 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 14.1 t0 -68.11 96.77 0.65 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.159 -0.473 . . . . 72.14 110.889 179.958 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 17.3 mmtt -75.16 -53.2 9.24 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.164 -0.471 . . . . 54.05 110.923 179.973 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 52.9 p30 -77.09 -9.07 58.49 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.215 -0.448 . . . . 73.35 110.808 179.919 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 59.6 26.51 62.42 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.74 -0.743 . . . . 71.5 112.459 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 37.8 p-10 -81.9 -16.12 51.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.878 0.37 . . . . 72.41 110.919 -179.905 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 90.08 18.76 49.21 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.773 -0.727 . . . . 42.41 112.483 179.927 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 15.0 m-85 -140.41 132.38 27.76 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.858 0.361 . . . . 72.13 110.917 -179.779 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 62.2 mt -101.2 135.04 39.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.138 -0.483 . . . . 70.5 111.151 179.902 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 89.5 p -117.1 -177.97 3.33 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.167 -0.469 . . . . 60.43 110.843 -179.881 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 102' ' ' ALA . . . . . 0.738 ' O ' HG11 ' A' ' 121' ' ' VAL . . . -70.32 -35.51 73.69 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.139 -0.482 . . . . 74.3 111.058 179.922 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -71.9 -35.28 69.66 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.246 -0.433 . . . . 43.24 111.104 179.931 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -76.88 -46.64 23.78 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.226 -0.443 . . . . 74.51 110.888 -179.909 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 19.0 tp -52.96 -48.01 67.72 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.175 -0.466 . . . . 72.43 110.893 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 106' ' ' ARG . . . . . 0.706 ' HB2' HG21 ' A' ' 121' ' ' VAL . 59.3 ttp85 -51.99 -40.04 60.31 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.199 -0.455 . . . . 64.42 110.858 179.975 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 13.5 t60 -55.85 -34.4 65.39 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.187 -0.46 . . . . 64.0 110.838 179.994 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 54.5 t -72.59 -52.03 25.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.235 -0.439 . . . . 75.21 111.122 -179.993 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 109' ' ' MET . . . . . 0.479 ' HB3' HD12 ' A' ' 116' ' ' LEU . 10.3 mmt -53.99 -28.12 35.91 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.153 -0.476 . . . . 72.41 110.874 179.908 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 4.0 m -66.9 -37.09 83.73 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.198 -0.455 . . . . 64.12 111.159 -179.907 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 43.0 t-20 -73.48 -26.12 60.76 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.212 -0.449 . . . . 55.4 110.904 179.975 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -70.69 -25.89 63.18 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.165 -0.47 . . . . 72.21 110.934 179.96 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 100.97 19.85 15.89 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.757 -0.735 . . . . 53.22 112.5 179.873 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -111.34 115.68 29.71 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.931 0.396 . . . . 74.0 110.892 -179.896 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 115' ' ' LYS . . . . . 0.584 ' O ' HD23 ' A' ' 116' ' ' LEU . 40.3 pttt -70.65 121.53 18.08 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.123 -0.489 . . . . 71.2 110.935 179.923 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.628 HD22 ' HG2' ' A' ' 120' ' ' GLU . 11.3 mt -143.33 161.0 39.49 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.235 -0.439 . . . . 63.33 110.935 179.947 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 67.9 p -118.59 174.33 6.33 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.205 -0.452 . . . . 63.1 111.089 179.993 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 47.8 m-20 -52.04 -48.35 64.63 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.182 -0.463 . . . . 64.43 110.865 179.9 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -60.67 -33.44 72.83 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.166 -0.47 . . . . 73.32 110.945 -179.929 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 120' ' ' GLU . . . . . 0.628 ' HG2' HD22 ' A' ' 116' ' ' LEU . 1.1 tp10 -68.97 -44.81 72.17 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.133 -0.485 . . . . 71.14 110.904 -179.979 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.738 HG11 ' O ' ' A' ' 102' ' ' ALA . 63.3 t -58.04 -33.32 46.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.174 -0.466 . . . . 71.23 111.106 179.963 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -51.97 -43.76 63.7 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.229 -0.441 . . . . 43.43 110.863 179.934 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 22.9 tp10 -56.33 -31.52 63.8 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.202 -0.454 . . . . 74.43 110.916 -179.928 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 124' ' ' MET . . . . . 0.403 ' HE3' ' HB3' ' M' ' 15' ' ' LYS . 80.0 mtp -76.03 -59.5 2.73 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.16 -0.473 . . . . 74.21 110.891 179.938 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 34.8 mm -53.99 -35.74 29.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.198 -0.455 . . . . 71.35 111.097 179.992 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 9.6 tpt180 -65.43 -31.76 73.02 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.187 -0.46 . . . . 75.13 110.842 179.991 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -71.97 -49.71 35.0 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.202 -0.454 . . . . 53.23 110.852 -179.908 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.563 ' HB3' HG22 ' A' ' 136' ' ' VAL . . . -70.39 -33.66 71.66 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.208 -0.451 . . . . 60.51 111.087 179.936 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 50.7 t0 -68.41 86.63 0.29 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.21 -0.45 . . . . 71.3 110.835 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 59.1 mt -79.98 -45.33 22.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.18 -0.464 . . . . 73.2 111.148 179.962 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 23.1 p30 -72.69 -8.82 57.24 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.168 -0.469 . . . . 61.02 110.833 179.866 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 62.8 43.76 98.47 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.725 -0.75 . . . . 31.33 112.481 -179.925 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 32.5 p-10 -89.33 -16.05 31.99 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.868 0.365 . . . . 64.32 110.882 -179.961 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 102.66 3.37 49.74 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.724 -0.75 . . . . 63.34 112.478 -179.964 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 3.8 tt0 -149.26 172.22 15.23 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.816 0.341 . . . . 74.14 110.923 -179.87 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 136' ' ' VAL . . . . . 0.563 HG22 ' HB3' ' A' ' 128' ' ' ALA . 98.9 t -113.18 114.87 48.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.248 -0.433 . . . . 73.42 111.192 179.94 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 41.9 p-10 -93.28 167.87 11.46 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.174 -0.466 . . . . 74.11 110.928 -179.975 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 138' ' ' TYR . . . . . 0.652 ' O ' HG23 ' A' ' 142' ' ' VAL . 14.1 t80 -51.96 -43.65 63.61 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.218 -0.446 . . . . 72.52 110.971 -179.931 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -55.74 -55.14 35.79 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.148 -0.478 . . . . 52.11 110.881 179.96 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 88.8 mt-10 -62.08 -45.42 93.58 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.172 -0.467 . . . . 65.32 110.9 -179.941 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 69.4 t80 -54.88 -54.94 36.03 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.129 -0.487 . . . . 73.45 110.903 -179.914 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 142' ' ' VAL . . . . . 0.652 HG23 ' O ' ' A' ' 138' ' ' TYR . 96.8 t -53.86 -43.35 56.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.13 -0.486 . . . . 55.41 111.172 179.91 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 5.5 tm0? -64.23 -58.42 6.62 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.155 -0.475 . . . . 71.25 110.934 179.978 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 11.3 tpt -57.5 -24.83 58.17 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.235 -0.439 . . . . 71.22 110.909 179.927 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 145' ' ' MET . . . . . 0.474 ' HE1' HG22 ' M' ' 19' ' ' ILE . 0.3 OUTLIER -86.75 -24.14 25.21 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.2 -0.455 . . . . 73.44 110.898 179.932 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 97.3 m . . . . . 0 C--N 1.33 -0.262 0 CA-C-N 116.234 -0.439 . . . . 71.01 111.119 -179.934 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' M' M ' 15' ' ' LYS . . . . . 0.403 ' HB3' ' HE3' ' A' ' 124' ' ' MET . 7.2 mttp . . . . . 0 C--O 1.232 0.135 0 CA-C-O 120.768 0.318 . . . . 72.45 110.895 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' M' M ' 16' ' ' TRP . . . . . . . . . . . . . 67.2 m95 -52.82 -41.46 64.23 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.216 -0.447 . . . . 74.51 110.893 179.909 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' M' M ' 17' ' ' GLU . . . . . . . . . . . . . 15.4 tm-20 -57.4 -30.2 64.74 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.241 -0.436 . . . . 71.53 110.893 -179.929 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' M' M ' 18' ' ' LYS . . . . . . . . . . . . . 15.5 tttp -62.91 -28.03 69.78 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.176 -0.465 . . . . 74.33 110.875 179.946 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' M' M ' 19' ' ' ILE . . . . . 0.474 HG22 ' HE1' ' A' ' 145' ' ' MET . 22.7 mt -98.66 -23.83 4.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.267 -0.424 . . . . 72.13 111.156 179.868 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' M' M ' 20' ' ' ARG . . . . . . . . . . . . . 30.6 ttt-85 . . . . . 0 C--N 1.329 -0.285 0 CA-C-N 116.185 -0.461 . . . . 75.41 110.836 -179.971 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' M' M ' 30' ' ' LYS . . . . . . . . . . . . . 2.1 pttp . . . . . 0 C--O 1.232 0.135 0 CA-C-O 120.776 0.322 . . . . 75.03 110.857 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' M' M ' 31' ' ' LEU . . . . . 0.593 ' HA ' HD12 ' M' ' 34' ' ' ILE . 7.2 tp -124.33 -48.78 1.82 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.228 -0.442 . . . . 71.25 110.918 179.935 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' M' M ' 32' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -47.21 -40.15 15.62 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.212 -0.449 . . . . 71.21 110.937 179.809 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' M' M ' 33' ' ' HIS . . . . . . . . . . . . . 79.9 t60 -48.12 -46.35 34.04 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.148 -0.478 . . . . 74.21 110.865 179.913 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' M' M ' 34' ' ' ILE . . . . . 0.593 HD12 ' HA ' ' M' ' 31' ' ' LEU . 3.3 mt -51.77 -38.57 22.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.214 -0.448 . . . . 72.24 111.096 179.996 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' M' M ' 35' ' ' VAL . . . . . 0.414 HG11 ' HE3' ' A' ' 72' ' ' MET . 48.5 t -50.1 -38.9 15.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.18 -0.464 . . . . 45.35 111.107 179.886 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' M' M ' 36' ' ' TRP . . . . . . . . . . . . . 26.6 m0 -59.29 -39.03 81.67 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.188 -0.46 . . . . 73.21 110.914 179.954 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' M' M ' 37' ' ' ALA . . . . . 0.891 ' HB3' HD13 ' A' ' 39' ' ' LEU . . . -63.94 -18.39 64.2 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.225 -0.443 . . . . 70.14 111.095 179.911 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' M' M ' 38' ' ' SER . . . . . 0.477 ' HB3' HD23 ' A' ' 18' ' ' LEU . 2.5 m -71.07 -17.94 62.58 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.243 -0.435 . . . . 50.34 110.857 -179.803 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' M' M ' 39' ' ' ARG . . . . . . . . . . . . . 14.9 mmm180 -52.07 -29.96 23.71 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.151 -0.477 . . . . 73.41 110.849 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' M' M ' 40' ' ' GLU . . . . . . . . . . . . . 9.4 tt0 -92.37 -40.71 10.74 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.21 -0.45 . . . . 64.44 110.915 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' M' M ' 41' ' ' LEU . . . . . 0.419 HD21 ' OG ' ' A' ' 38' ' ' SER . 5.0 mt . . . . . 0 C--N 1.328 -0.329 0 CA-C-N 116.162 -0.472 . . . . 62.13 110.931 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 1.6 tp-100 . . . . . 0 C--O 1.232 0.138 0 CA-C-O 120.734 0.302 . . . . 72.14 110.904 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 62.0 mt -67.04 -37.14 78.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.212 -0.449 . . . . 55.1 111.124 179.976 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -51.95 -49.9 62.27 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.191 -0.459 . . . . 63.54 111.098 179.815 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 25.3 mm-40 -54.87 -52.24 63.45 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.179 -0.464 . . . . 74.42 110.931 -179.966 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 66.0 m-85 -60.04 -44.17 94.83 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.123 -0.489 . . . . 73.43 110.933 -179.953 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 38.0 ttmt -51.98 -33.5 38.26 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.088 -0.505 . . . . 63.1 110.866 -179.996 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -68.74 -36.65 78.66 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.234 -0.439 . . . . 71.11 110.904 179.975 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -66.52 -52.28 47.52 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.14 -0.482 . . . . 40.02 111.076 179.931 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 42.4 t80 -52.6 -47.44 66.94 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.19 -0.459 . . . . 63.44 110.859 -179.898 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.6 m -59.48 -28.98 67.5 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.156 -0.475 . . . . 53.51 110.885 -179.793 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.65 HD23 ' HB3' ' M' ' 38' ' ' SER . 15.3 tp -68.59 -47.54 66.48 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.111 -0.495 . . . . 75.4 110.897 -179.995 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 62.1 m-85 -71.67 -26.09 62.39 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.178 -0.465 . . . . 61.02 110.89 179.928 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 18.6 t0 -86.33 98.47 10.99 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.154 -0.475 . . . . 71.42 110.845 -179.996 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 39.6 mtpt -71.86 -53.12 14.21 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.216 -0.447 . . . . 74.21 110.862 -179.977 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 26.3 p-10 -73.5 -10.11 59.39 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.244 -0.435 . . . . 73.44 110.802 179.912 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 52.03 46.45 55.88 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.792 -0.718 . . . . 52.45 112.451 -179.946 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 26.7 p-10 -88.46 -15.73 34.62 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.891 0.377 . . . . 71.5 110.906 179.993 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 105.32 -11.73 47.65 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.696 -0.764 . . . . 65.03 112.508 -179.902 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 51.6 p -131.31 130.71 43.09 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.755 0.312 . . . . 72.23 111.157 -179.886 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 29.8 mt -90.72 135.82 25.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.206 -0.452 . . . . 65.34 111.138 179.898 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.672 HG22 HG22 ' A' ' 62' ' ' THR . 15.0 p -115.97 -179.37 3.64 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.195 -0.457 . . . . 61.04 111.176 179.936 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.685 HG23 HD12 ' A' ' 52' ' ' ILE . 8.2 p -68.69 -33.02 73.25 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.227 -0.442 . . . . 73.25 111.167 -179.988 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 14.8 ptpt -69.6 -41.42 75.75 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.194 -0.457 . . . . 75.32 110.889 179.878 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.491 ' O ' HG23 ' A' ' 35' ' ' VAL . 62.1 mt-10 -75.9 -35.4 59.83 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.22 -0.445 . . . . 75.34 110.924 179.968 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.1 tt -74.31 -53.78 9.01 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.136 -0.484 . . . . 75.55 110.904 -179.962 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -52.1 -43.28 56.08 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.801 -0.714 . . . . 65.41 112.488 179.904 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 96.0 m -56.97 -55.07 39.45 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.816 0.341 . . . . 75.3 111.146 -179.896 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.491 HG23 ' O ' ' A' ' 31' ' ' GLU . 100.0 t -51.67 -50.22 31.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.21 -0.45 . . . . 65.13 111.096 179.937 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 7.5 mtp -51.97 -39.07 58.77 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.16 -0.473 . . . . 61.31 110.905 179.932 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 30.1 ttt85 -54.11 -40.15 67.04 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.179 -0.464 . . . . 63.5 110.837 -179.9 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' SER . . . . . 0.611 ' OG ' HD21 ' M' ' 41' ' ' LEU . 3.8 t -76.8 -28.39 55.59 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.179 -0.464 . . . . 60.43 110.904 -179.809 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 1.009 HD13 ' HB3' ' M' ' 37' ' ' ALA . 58.6 mt -76.98 -21.49 54.63 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.127 -0.488 . . . . 72.51 110.909 179.986 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 101.45 31.11 5.65 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.753 -0.737 . . . . 73.32 112.476 179.858 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 2.2 tp-100 -116.96 140.32 49.61 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.842 0.353 . . . . 75.21 110.856 -179.85 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 29.8 t30 -109.87 76.8 0.99 Allowed Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.63 0.729 . . . . 72.12 110.913 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.75 140.0 41.64 Favored 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.71 2.274 . . . . 60.02 112.311 179.951 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 19.9 p -97.29 158.35 15.5 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.2 -0.454 . . . . 74.54 111.157 -179.986 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -51.94 -43.41 63.46 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.225 -0.443 . . . . 75.42 110.914 179.966 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.36 -32.93 64.81 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.18 -0.463 . . . . 65.32 111.088 179.937 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 11.0 tt0 -67.57 -50.77 56.85 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.194 -0.457 . . . . 55.44 110.89 -179.936 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.66 ' HB3' HG22 ' A' ' 29' ' ' THR . 45.9 mt -55.05 -51.85 65.02 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.172 -0.467 . . . . 70.2 110.951 179.984 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 29.8 tp60 -57.24 -29.07 63.47 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.148 -0.478 . . . . 65.33 110.94 179.89 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -72.17 -37.6 69.3 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.208 -0.451 . . . . 72.1 110.881 179.964 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' MET . . . . . 0.49 ' O ' HG22 ' A' ' 55' ' ' VAL . 5.7 mtp -63.7 -57.89 8.59 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.172 -0.467 . . . . 73.33 110.858 179.985 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.685 HD12 HG23 ' A' ' 29' ' ' THR . 62.4 mt -54.89 -45.27 75.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.243 -0.435 . . . . 74.41 111.143 179.972 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 76.8 m-20 -66.32 -33.84 76.63 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.183 -0.462 . . . . 71.33 110.884 179.921 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -63.12 -30.56 71.68 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.212 -0.449 . . . . 75.01 110.861 -179.965 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.49 HG22 ' O ' ' A' ' 51' ' ' MET . 4.8 m -111.12 18.98 7.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.162 -0.472 . . . . 73.15 111.095 -179.987 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 31.5 t0 -89.99 93.06 9.25 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.205 -0.452 . . . . 63.11 110.889 179.893 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.16 -33.71 18.1 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.249 -0.432 . . . . 71.15 111.079 179.962 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 14.7 p30 -91.35 -0.15 57.61 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.226 -0.443 . . . . 35.52 110.868 179.962 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 52.35 59.54 8.86 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.726 -0.75 . . . . 70.41 112.496 -179.899 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 51.5 p-10 -114.48 -15.73 12.01 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.833 0.349 . . . . 70.23 110.919 -179.926 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 89.77 18.46 51.32 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.715 -0.755 . . . . 72.23 112.505 179.966 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' THR . . . . . 0.672 HG22 HG22 ' A' ' 28' ' ' THR . 22.5 p -152.65 159.37 43.2 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.788 0.328 . . . . 54.32 111.167 -179.914 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.465 HG21 ' HD1' ' A' ' 68' ' ' PHE . 25.1 mt -91.94 109.48 21.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.215 -0.448 . . . . 75.4 111.137 179.907 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.4 t0 -73.82 -176.42 2.43 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.152 -0.476 . . . . 70.51 110.867 179.875 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.534 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 2.5 t80 -62.85 -58.32 17.19 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-O 121.652 0.739 . . . . 72.3 110.914 -179.887 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 66' ' ' PRO . . . . . 0.534 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 53.7 Cg_endo -69.81 -30.02 22.7 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.697 2.264 . . . . 52.13 112.344 179.982 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 -57.24 -41.47 79.6 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.205 -0.452 . . . . 72.13 110.918 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' PHE . . . . . 0.465 ' HD1' HG21 ' A' ' 63' ' ' ILE . 24.2 t80 -74.14 -36.1 64.12 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.106 -0.497 . . . . 75.4 110.886 -179.971 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 28.9 tp -65.48 -53.65 39.5 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.155 -0.475 . . . . 72.14 110.887 -179.937 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 11.2 t -54.02 -26.69 27.61 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.247 -0.433 . . . . 74.44 111.129 179.967 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' MET . . . . . 0.411 ' SD ' HD23 ' M' ' 31' ' ' LEU . 42.9 ttp -70.67 -35.46 72.85 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.208 -0.451 . . . . 73.43 110.89 179.937 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 11.1 mtp -77.69 -33.72 53.14 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.213 -0.449 . . . . 73.24 110.888 179.938 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.284 0 CA-C-N 116.227 -0.442 . . . . 54.31 111.059 179.958 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.562 HG23 ' HE1' ' A' ' 141' ' ' PHE . 54.8 mt . . . . . 0 N--CA 1.458 -0.068 0 CA-C-O 120.835 0.35 . . . . 71.42 111.133 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.16 -30.3 26.15 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.104 -0.498 . . . . 73.11 110.882 179.988 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.411 ' O ' HG23 ' A' ' 91' ' ' VAL . 11.1 tt0 -76.41 -56.95 4.16 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.211 -0.449 . . . . 74.3 110.866 -179.953 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 88' ' ' ALA . . . . . 0.503 ' HB1' ' CE2' ' A' ' 92' ' ' PHE . . . -54.82 -43.23 72.78 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.141 -0.482 . . . . 73.5 111.089 179.962 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 8.8 t80 -52.02 -51.19 59.01 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.226 -0.443 . . . . 75.21 110.892 -179.953 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 50.3 ttt-85 -58.84 -44.89 91.07 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.124 -0.489 . . . . 73.24 110.902 -179.939 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 91' ' ' VAL . . . . . 0.411 HG23 ' O ' ' A' ' 87' ' ' GLU . 57.6 t -54.67 -49.36 68.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.178 -0.465 . . . . 63.24 111.185 179.938 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.503 ' CE2' ' HB1' ' A' ' 88' ' ' ALA . 8.9 m-85 -70.92 -32.36 69.26 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.149 -0.478 . . . . 72.15 110.889 179.986 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 16.6 t0 -61.71 96.72 0.07 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.175 -0.466 . . . . 75.21 110.822 179.983 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 58.2 mmtt -76.24 -53.17 8.64 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.175 -0.466 . . . . 60.02 110.876 179.993 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 56.0 p-10 -76.02 -9.17 58.4 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.216 -0.447 . . . . 72.44 110.872 179.868 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 59.64 26.87 63.03 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.733 -0.746 . . . . 24.43 112.45 -179.96 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 42.4 p-10 -81.77 -16.17 51.87 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.863 0.363 . . . . 75.1 110.908 -179.956 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 91.89 18.75 42.63 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.748 -0.739 . . . . 73.21 112.494 -179.998 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 6.2 m-85 -136.42 159.32 42.12 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.855 0.36 . . . . 72.02 110.907 -179.802 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 62.8 mt -122.4 123.95 69.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.143 -0.48 . . . . 65.41 111.127 179.93 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 63.2 p -107.17 -172.58 2.11 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.175 -0.466 . . . . 54.12 110.835 -179.913 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 102' ' ' ALA . . . . . 0.675 ' O ' HG11 ' A' ' 121' ' ' VAL . . . -73.96 -36.6 64.6 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.112 -0.494 . . . . 55.03 111.056 179.935 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -72.0 -31.37 66.16 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.228 -0.442 . . . . 73.51 111.11 179.983 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -74.9 -48.69 23.39 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.163 -0.471 . . . . 71.53 110.882 -179.924 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 22.1 tp -54.02 -47.89 71.05 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.162 -0.472 . . . . 74.22 110.937 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 106' ' ' ARG . . . . . 0.56 ' O ' HG23 ' A' ' 110' ' ' THR . 42.2 ttp85 -52.37 -44.53 65.33 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.182 -0.463 . . . . 71.45 110.904 179.911 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 11.1 t60 -58.45 -34.53 70.94 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.202 -0.453 . . . . 74.03 110.832 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 92.7 t -67.04 -52.2 46.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.201 -0.454 . . . . 71.21 111.175 179.948 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 109' ' ' MET . . . . . 0.421 ' HA ' HD12 ' A' ' 112' ' ' LEU . 4.2 mmt -64.2 -46.07 85.5 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.139 -0.482 . . . . 61.33 110.85 179.905 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 110' ' ' THR . . . . . 0.56 HG23 ' O ' ' A' ' 106' ' ' ARG . 41.8 p -51.88 -37.16 51.18 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.24 -0.436 . . . . 61.32 111.174 -179.933 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 43.8 t30 -57.86 -33.7 68.96 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.211 -0.45 . . . . 72.34 110.916 179.953 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.699 HD13 ' HE3' ' M' ' 18' ' ' LYS . 15.3 mt -70.7 -23.9 62.55 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.151 -0.477 . . . . 72.4 110.908 179.943 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 101.06 32.93 5.13 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.714 -0.755 . . . . 74.32 112.428 179.883 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -110.07 116.27 31.26 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.92 0.391 . . . . 74.24 110.898 -179.918 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 29.3 tttm -60.73 120.29 9.79 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.153 -0.476 . . . . 73.31 110.931 179.96 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.452 HD22 ' HG2' ' A' ' 120' ' ' GLU . 19.8 mt -145.88 155.42 42.87 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.246 -0.434 . . . . 71.04 110.897 179.92 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 41.0 p -118.73 169.03 10.18 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.168 -0.469 . . . . 72.42 111.177 179.943 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 41.2 m-20 -53.07 -46.08 68.43 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.268 -0.424 . . . . 72.42 110.897 179.887 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 17.9 tt0 -63.54 -34.23 77.35 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.188 -0.46 . . . . 71.33 110.867 -179.921 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 120' ' ' GLU . . . . . 0.452 ' HG2' HD22 ' A' ' 116' ' ' LEU . 2.3 tp10 -67.23 -32.65 73.84 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.186 -0.461 . . . . 64.33 110.871 -179.902 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.675 HG11 ' O ' ' A' ' 102' ' ' ALA . 92.8 t -69.48 -32.67 53.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.154 -0.475 . . . . 62.31 111.137 179.971 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 10.8 t0 -51.95 -46.92 64.92 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.18 -0.464 . . . . 63.32 110.878 179.948 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -55.74 -29.3 59.32 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.131 -0.486 . . . . 72.5 110.873 -179.898 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 1.2 mtp -75.37 -59.74 2.61 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.155 -0.475 . . . . 65.21 110.866 -179.997 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 35.5 mm -54.13 -35.61 29.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.215 -0.448 . . . . 71.33 111.11 179.977 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 51.2 ttt180 -63.03 -31.78 72.99 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.174 -0.466 . . . . 74.51 110.893 179.957 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 9.7 tt0 -75.33 -52.48 10.71 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.183 -0.462 . . . . 71.32 110.883 -179.893 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.528 ' HB3' ' CG2' ' A' ' 136' ' ' VAL . . . -64.92 -33.87 77.07 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.117 -0.492 . . . . 52.44 111.071 179.959 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 49.5 t0 -68.73 86.31 0.32 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.238 -0.437 . . . . 73.33 110.882 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 130' ' ' ILE . . . . . 0.694 HD12 ' HG2' ' A' ' 140' ' ' GLU . 4.0 mt -79.91 -45.72 22.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.229 -0.442 . . . . 75.02 111.128 -179.952 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 22.0 p30 -72.77 -8.8 57.18 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.184 -0.462 . . . . 73.41 110.88 179.823 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 62.86 44.41 97.48 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.73 -0.748 . . . . 55.54 112.518 -179.891 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 31.8 p-10 -90.44 -15.95 29.92 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.841 0.353 . . . . 75.24 110.882 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 101.97 3.77 51.62 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.726 -0.75 . . . . 75.21 112.518 -179.906 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 4.4 tt0 -149.29 172.31 15.09 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.873 0.368 . . . . 75.41 110.91 -179.857 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 136' ' ' VAL . . . . . 0.528 ' CG2' ' HB3' ' A' ' 128' ' ' ALA . 66.9 t -114.78 111.09 34.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.187 -0.461 . . . . 53.15 111.166 179.964 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 45.4 p-10 -93.67 171.66 8.75 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.17 -0.468 . . . . 70.4 110.915 -179.986 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 138' ' ' TYR . . . . . 0.701 ' O ' HG23 ' A' ' 142' ' ' VAL . 86.9 t80 -56.18 -46.83 79.21 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.232 -0.44 . . . . 72.42 110.901 -179.901 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 22.1 tt0 -52.11 -44.56 64.51 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.097 -0.501 . . . . 63.03 110.914 -179.981 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 140' ' ' GLU . . . . . 0.694 ' HG2' HD12 ' A' ' 130' ' ' ILE . 94.9 mt-10 -73.94 -40.26 63.2 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.166 -0.47 . . . . 62.51 110.87 -179.929 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 141' ' ' PHE . . . . . 0.562 ' HE1' HG23 ' A' ' 85' ' ' ILE . 42.7 t80 -60.47 -41.34 93.97 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.176 -0.465 . . . . 72.01 110.884 -179.936 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 142' ' ' VAL . . . . . 0.701 HG23 ' O ' ' A' ' 138' ' ' TYR . 99.7 t -60.19 -49.46 84.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.165 -0.47 . . . . 72.24 111.162 179.963 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 143' ' ' GLN . . . . . 0.548 ' HA ' HG22 ' A' ' 146' ' ' THR . 29.7 tt0 -72.28 -23.47 61.19 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.191 -0.459 . . . . 75.2 110.911 179.994 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 10.8 tpt -74.99 -18.79 60.31 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.241 -0.436 . . . . 72.31 110.872 179.958 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 9.2 ttm -98.22 -32.93 11.31 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.214 -0.448 . . . . 74.1 110.894 179.94 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 146' ' ' THR . . . . . 0.548 HG22 ' HA ' ' A' ' 143' ' ' GLN . 5.0 t . . . . . 0 C--N 1.329 -0.309 0 CA-C-N 116.243 -0.435 . . . . 43.15 111.11 -179.91 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' M' M ' 15' ' ' LYS . . . . . . . . . . . . . 3.0 mttp . . . . . 0 C--O 1.23 0.075 0 CA-C-O 120.729 0.299 . . . . 54.34 110.901 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' M' M ' 16' ' ' TRP . . . . . . . . . . . . . 73.9 m95 -50.85 -32.74 21.26 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.199 -0.455 . . . . 71.23 110.929 179.918 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' M' M ' 17' ' ' GLU . . . . . . . . . . . . . 59.1 tt0 -54.08 -34.54 60.41 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.218 -0.447 . . . . 73.32 110.914 179.998 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' M' M ' 18' ' ' LYS . . . . . 0.699 ' HE3' HD13 ' A' ' 112' ' ' LEU . 23.4 tttp -65.16 -28.55 69.48 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.152 -0.476 . . . . 71.42 110.908 179.953 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' M' M ' 19' ' ' ILE . . . . . . . . . . . . . 28.6 mt -90.7 -29.98 4.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.214 -0.448 . . . . 64.22 111.157 179.879 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' M' M ' 20' ' ' ARG . . . . . . . . . . . . . 39.0 ttp85 . . . . . 0 C--N 1.329 -0.283 0 CA-C-N 116.147 -0.479 . . . . 75.43 110.87 179.928 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' M' M ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.133 0 CA-C-O 120.815 0.34 . . . . 53.42 110.891 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' M' M ' 31' ' ' LEU . . . . . 0.896 HD12 HD12 ' M' ' 34' ' ' ILE . 14.8 tp -124.39 -41.44 2.17 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.262 -0.426 . . . . 70.42 110.926 179.935 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' M' M ' 32' ' ' LYS . . . . . . . . . . . . . 42.6 tttt -49.57 -42.87 45.49 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.178 -0.465 . . . . 53.14 110.909 179.827 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' M' M ' 33' ' ' HIS . . . . . . . . . . . . . 80.7 t60 -50.33 -39.19 45.27 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.185 -0.461 . . . . 73.54 110.851 179.912 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' M' M ' 34' ' ' ILE . . . . . 0.896 HD12 HD12 ' M' ' 31' ' ' LEU . 62.3 mt -50.7 -39.46 18.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.204 -0.453 . . . . 70.22 111.138 179.987 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' M' M ' 35' ' ' VAL . . . . . . . . . . . . . 98.9 t -49.8 -39.22 14.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.129 -0.487 . . . . 74.32 111.158 179.863 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' M' M ' 36' ' ' TRP . . . . . . . . . . . . . 29.9 m0 -58.85 -39.16 80.48 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.139 -0.482 . . . . 73.54 110.933 179.965 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' M' M ' 37' ' ' ALA . . . . . 1.009 ' HB3' HD13 ' A' ' 39' ' ' LEU . . . -63.9 -18.59 64.36 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.216 -0.447 . . . . 62.34 111.117 179.88 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' M' M ' 38' ' ' SER . . . . . 0.65 ' HB3' HD23 ' A' ' 18' ' ' LEU . 0.7 OUTLIER -73.94 -17.9 60.96 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.185 -0.461 . . . . 30.33 110.848 -179.742 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' M' M ' 39' ' ' ARG . . . . . . . . . . . . . 50.7 mtp180 -55.55 -31.4 62.11 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.131 -0.486 . . . . 72.13 110.85 -179.944 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' M' M ' 40' ' ' GLU . . . . . . . . . . . . . 14.3 tp10 -79.94 -46.53 16.55 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.156 -0.474 . . . . 73.52 110.89 -179.934 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' M' M ' 41' ' ' LEU . . . . . 0.611 HD21 ' OG ' ' A' ' 38' ' ' SER . 11.9 mt . . . . . 0 C--N 1.328 -0.35 0 CA-C-N 116.14 -0.482 . . . . 72.41 110.89 -179.936 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 8.5 tp-100 . . . . . 0 C--O 1.232 0.139 0 CA-C-O 120.79 0.329 . . . . 72.11 110.942 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 59.2 mt -70.5 -43.33 78.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.238 -0.437 . . . . 65.24 111.116 179.932 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -52.11 -29.62 22.54 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.21 -0.45 . . . . 55.55 111.078 179.847 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 43.7 mm-40 -74.66 -52.0 12.84 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.28 -0.418 . . . . 73.13 110.882 -179.952 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 24.2 m-85 -61.91 -46.04 91.08 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.153 -0.476 . . . . 75.31 110.845 -179.88 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 34.1 ttmt -55.33 -26.98 44.07 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.117 -0.492 . . . . 72.23 110.95 179.962 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 56.4 tt0 -72.61 -38.72 67.72 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.222 -0.445 . . . . 74.42 110.888 179.927 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -63.77 -43.4 96.5 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.181 -0.463 . . . . 73.5 111.103 179.942 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 67.1 t80 -57.12 -53.7 55.06 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.197 -0.456 . . . . 63.14 110.904 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 46.9 m -52.35 -34.24 46.53 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.133 -0.485 . . . . 74.13 110.871 -179.795 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.64 HD23 ' HB3' ' M' ' 38' ' ' SER . 16.6 tp -62.43 -46.68 87.46 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.09 -0.505 . . . . 70.23 110.913 179.996 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.491 ' CE1' HG11 ' A' ' 35' ' ' VAL . 46.2 m-85 -71.95 -25.98 62.1 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.2 -0.454 . . . . 44.31 110.877 179.933 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 13.9 t0 -82.69 98.54 9.11 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.138 -0.483 . . . . 72.31 110.852 179.995 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 15.8 ttmm -67.88 -51.76 44.37 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.168 -0.469 . . . . 63.04 110.863 -179.989 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 29.9 p-10 -79.57 -10.1 59.74 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.217 -0.447 . . . . 63.35 110.884 179.925 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 51.96 44.32 55.99 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.764 -0.732 . . . . 51.4 112.454 -179.938 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 17.2 p-10 -88.5 -15.72 34.55 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.813 0.339 . . . . 74.14 110.851 -179.989 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 102.24 17.09 21.19 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.716 -0.754 . . . . 64.11 112.521 -179.919 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -154.58 131.43 10.81 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.76 0.315 . . . . 51.41 111.133 -179.85 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.436 HG21 HD23 ' A' ' 32' ' ' LEU . 23.3 mt -92.51 111.67 24.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.256 -0.429 . . . . 64.25 111.128 179.941 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.698 HG22 HG21 ' A' ' 62' ' ' THR . 19.6 p -97.78 178.21 5.22 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.2 -0.454 . . . . 72.32 111.093 -179.989 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 3.0 p -62.77 -27.19 69.12 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.205 -0.452 . . . . 73.24 111.184 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 7.8 mmmm -69.78 -50.09 46.56 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.173 -0.467 . . . . 42.1 110.899 179.93 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.42 ' O ' HG23 ' A' ' 35' ' ' VAL . 33.6 mt-10 -74.24 -32.71 63.08 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.214 -0.448 . . . . 74.12 110.899 179.95 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.576 HD13 ' O ' ' A' ' 32' ' ' LEU . 1.0 OUTLIER -74.14 -41.26 61.82 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.145 -0.479 . . . . 75.51 110.912 179.996 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -70.67 -34.43 66.93 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.801 -0.714 . . . . 74.24 112.5 179.887 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 96.7 m -67.43 -59.88 3.02 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.784 0.326 . . . . 70.3 111.136 -179.809 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.491 HG11 ' CE1' ' A' ' 19' ' ' PHE . 66.7 t -52.94 -52.11 31.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.194 -0.457 . . . . 72.33 111.132 179.903 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 6.3 ttt -51.93 -29.97 22.5 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.179 -0.464 . . . . 74.41 110.902 179.899 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 3.7 tmm_? -72.65 -52.85 13.64 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.17 -0.468 . . . . 71.11 110.884 -179.971 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 4.6 t -58.52 -25.69 62.69 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.23 -0.441 . . . . 74.33 110.907 -179.811 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.98 HD13 ' HB3' ' M' ' 37' ' ' ALA . 61.2 mt -78.15 -13.88 59.69 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.101 -0.5 . . . . 64.34 110.936 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 101.5 23.88 9.19 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.778 -0.725 . . . . 52.35 112.518 179.936 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 8.3 tp-100 -124.59 129.35 50.4 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.785 0.326 . . . . 72.53 110.931 -179.904 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 61.1 t30 -109.71 82.46 2.31 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.591 0.71 . . . . 71.13 110.902 -179.957 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.8 167.97 22.95 Favored 'Trans proline' 0 C--O 1.232 0.221 0 C-N-CA 122.72 2.28 . . . . 52.43 112.324 179.988 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 20.5 p -112.53 155.47 24.27 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.249 -0.432 . . . . 61.33 111.195 -179.993 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -51.91 -40.51 60.84 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.227 -0.442 . . . . 52.13 110.886 179.984 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.44 -31.46 63.83 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.145 -0.48 . . . . 73.05 111.112 179.973 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -70.76 -49.71 43.82 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.217 -0.447 . . . . 73.33 110.873 -179.933 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.522 ' CD2' HD12 ' A' ' 32' ' ' LEU . 13.9 mt -55.07 -51.0 67.73 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.175 -0.466 . . . . 72.25 110.926 -179.986 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 15.4 tp60 -59.93 -28.39 67.58 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.171 -0.468 . . . . 75.25 110.906 179.928 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 38.3 t0 -74.63 -49.96 19.55 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.22 -0.446 . . . . 52.11 110.865 -179.996 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 14.6 ptm -66.92 -42.49 85.29 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.212 -0.449 . . . . 64.44 110.894 179.976 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 97.1 mt -65.83 -38.11 81.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.149 -0.478 . . . . 61.54 111.12 179.97 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 33.6 m-20 -62.28 -36.17 81.25 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.18 -0.464 . . . . 65.15 110.847 179.959 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 24.9 mm-40 -63.62 -29.73 70.94 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.216 -0.447 . . . . 64.34 110.9 -179.963 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 9.7 m -105.34 12.68 8.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.151 -0.477 . . . . 74.44 111.114 179.967 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 30.7 t0 -90.01 98.73 11.94 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.232 -0.44 . . . . 73.0 110.857 179.953 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.34 -44.71 10.59 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.21 -0.45 . . . . 32.45 111.1 179.957 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 41.2 p30 -82.93 -0.2 47.43 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.219 -0.446 . . . . 74.14 110.837 -179.999 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 55.2 55.34 28.78 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.731 -0.747 . . . . 62.4 112.477 -179.927 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 48.7 p-10 -114.64 -15.74 11.92 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.891 0.376 . . . . 72.22 110.867 -179.895 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 92.71 19.14 38.39 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.799 -0.715 . . . . 62.41 112.478 179.96 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' THR . . . . . 0.698 HG21 HG22 ' A' ' 28' ' ' THR . 26.7 p -146.52 165.91 28.04 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.749 0.309 . . . . 43.24 111.148 -179.881 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.434 HD13 HD21 ' M' ' 31' ' ' LEU . 18.5 mt -96.23 109.43 22.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.219 -0.446 . . . . 72.33 111.132 179.915 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -74.04 -177.81 3.06 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.205 -0.452 . . . . 65.41 110.901 179.839 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.533 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 2.5 t80 -61.6 -58.35 18.98 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.636 0.731 . . . . 60.44 110.891 -179.886 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 66' ' ' PRO . . . . . 0.533 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 53.9 Cg_endo -69.78 -29.73 23.3 Favored 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.668 2.245 . . . . 65.51 112.299 -179.991 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 80.6 mt-10 -58.57 -40.02 81.95 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.268 -0.424 . . . . 73.02 110.868 -179.963 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 50.4 t80 -73.79 -36.05 65.0 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.119 -0.491 . . . . 72.4 110.894 -179.923 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 16.4 tp -68.84 -53.84 19.12 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.177 -0.465 . . . . 73.25 110.932 -179.976 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 14.1 t -52.9 -28.45 23.34 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.214 -0.448 . . . . 74.12 111.154 179.964 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 39.6 ttp -65.24 -42.46 93.35 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.231 -0.441 . . . . 71.43 110.873 179.876 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -71.97 -35.75 69.61 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.218 -0.447 . . . . 62.23 110.848 179.975 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.237 -0.438 . . . . 70.43 111.078 179.926 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.438 HG21 HG22 ' A' ' 142' ' ' VAL . 51.4 mt . . . . . 0 C--O 1.23 0.07 0 CA-C-O 120.831 0.348 . . . . 74.14 111.181 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 51.2 ttt180 -66.04 -33.5 75.94 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.131 -0.486 . . . . 75.21 110.847 179.969 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.681 ' O ' HG23 ' A' ' 91' ' ' VAL . 0.3 OUTLIER -76.41 -34.94 58.8 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.241 -0.436 . . . . 70.42 110.878 -179.912 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 88' ' ' ALA . . . . . 0.418 ' HB1' ' CE2' ' A' ' 92' ' ' PHE . . . -76.62 -34.49 58.35 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.149 -0.478 . . . . 45.04 111.086 179.94 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -61.57 -48.63 80.08 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.216 -0.447 . . . . 71.54 110.879 -179.936 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 12.9 ptm180 -60.76 -25.93 66.85 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.168 -0.469 . . . . 73.24 110.865 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 91' ' ' VAL . . . . . 0.681 HG23 ' O ' ' A' ' 87' ' ' GLU . 94.0 t -75.58 -51.21 21.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.234 -0.439 . . . . 73.05 111.136 179.98 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.455 ' CE1' HG11 ' A' ' 108' ' ' VAL . 8.9 m-85 -70.79 -26.61 63.4 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.184 -0.462 . . . . 73.41 110.882 -179.983 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 33.1 t0 -76.52 88.91 3.26 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.157 -0.474 . . . . 71.13 110.864 179.954 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 59.4 mmtt -75.31 -51.04 14.17 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.203 -0.453 . . . . 72.33 110.914 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 31.2 p30 -72.58 -9.08 58.15 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.233 -0.439 . . . . 51.52 110.882 179.857 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 59.96 27.72 65.06 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.765 -0.731 . . . . 73.42 112.527 -179.9 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 44.7 p-10 -82.88 -16.12 48.79 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.899 0.38 . . . . 74.5 110.909 -179.878 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 89.08 18.72 53.22 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.752 -0.737 . . . . 73.23 112.491 179.981 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 20.2 m-85 -137.51 152.39 49.44 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.824 0.345 . . . . 71.44 110.945 -179.798 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 65.2 mt -122.63 114.64 43.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.135 -0.484 . . . . 74.04 111.152 179.916 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 6.8 p -107.19 165.43 11.37 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.208 -0.451 . . . . 53.31 110.87 -179.926 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 102' ' ' ALA . . . . . 0.502 ' HB2' HG13 ' A' ' 125' ' ' ILE . . . -51.85 -29.83 21.21 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.136 -0.484 . . . . 50.31 111.11 179.904 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -68.92 -43.11 75.83 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.191 -0.459 . . . . 61.02 111.096 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 83.5 mt-10 -76.8 -49.4 15.95 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.185 -0.461 . . . . 55.55 110.916 -179.956 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 24.3 tp -53.31 -47.62 69.1 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.187 -0.46 . . . . 72.34 110.891 -179.981 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 106' ' ' ARG . . . . . 0.75 ' HB2' HG21 ' A' ' 121' ' ' VAL . 46.9 ttp180 -53.02 -31.31 40.45 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.219 -0.446 . . . . 73.52 110.887 179.954 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 63.0 t60 -69.27 -34.41 74.72 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.168 -0.469 . . . . 74.14 110.889 179.977 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.455 HG11 ' CE1' ' A' ' 92' ' ' PHE . 45.3 t -70.0 -32.24 50.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.238 -0.437 . . . . 75.42 111.113 -179.989 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 7.8 mmt -73.09 -43.75 61.36 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.158 -0.473 . . . . 63.33 110.844 179.931 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -54.99 -41.13 70.86 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.243 -0.435 . . . . 71.31 111.145 -179.907 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 61.0 m-20 -71.57 -32.24 67.86 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.203 -0.453 . . . . 72.41 110.88 179.997 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 5.0 mt -70.75 -25.75 63.05 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.148 -0.478 . . . . 75.44 110.923 179.959 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 101.07 32.42 5.3 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.787 -0.72 . . . . 65.21 112.454 179.88 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -113.75 109.97 19.42 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.896 0.379 . . . . 72.25 110.875 -179.861 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 115' ' ' LYS . . . . . 0.418 ' O ' HD23 ' A' ' 116' ' ' LEU . 0.6 OUTLIER -66.61 108.08 2.32 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.159 -0.473 . . . . 63.53 110.876 179.984 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.603 HD22 ' HG2' ' A' ' 120' ' ' GLU . 10.4 mt -143.63 160.38 40.77 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.218 -0.446 . . . . 55.11 110.954 179.894 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 117' ' ' THR . . . . . 0.557 ' O ' HG23 ' A' ' 121' ' ' VAL . 31.9 p -118.86 177.01 5.01 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.217 -0.447 . . . . 73.2 111.139 179.986 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -57.05 -43.74 82.3 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.245 -0.434 . . . . 65.3 110.845 179.938 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -65.0 -33.44 76.06 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.212 -0.449 . . . . 71.31 110.845 -179.87 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 120' ' ' GLU . . . . . 0.603 ' HG2' HD22 ' A' ' 116' ' ' LEU . 1.2 tp10 -70.12 -43.92 70.0 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.143 -0.48 . . . . 72.25 110.926 -179.974 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.75 HG21 ' HB2' ' A' ' 106' ' ' ARG . 48.6 t -59.19 -31.94 47.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.155 -0.475 . . . . 54.4 111.114 179.976 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 11.7 t0 -52.01 -42.77 63.28 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.226 -0.443 . . . . 74.04 110.856 179.916 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -55.76 -32.65 63.61 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.179 -0.464 . . . . 73.5 110.895 -179.909 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 30.8 mtp -76.05 -59.17 2.88 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.164 -0.471 . . . . 71.11 110.882 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.502 HG13 ' HB2' ' A' ' 102' ' ' ALA . 36.0 mm -53.92 -35.73 28.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.218 -0.446 . . . . 73.5 111.12 179.931 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 24.0 ttm180 -63.44 -31.85 73.13 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.178 -0.464 . . . . 74.15 110.898 179.944 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 21.0 tp10 -74.75 -52.38 11.68 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.161 -0.472 . . . . 72.21 110.842 -179.901 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.653 ' HB3' HG22 ' A' ' 136' ' ' VAL . . . -65.21 -34.41 78.3 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.159 -0.473 . . . . 75.33 111.088 179.982 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 49.4 t0 -68.42 86.74 0.3 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.217 -0.447 . . . . 51.33 110.882 179.968 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 60.6 mt -79.81 -46.15 22.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.172 -0.467 . . . . 71.52 111.126 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 21.2 p30 -72.78 -8.7 56.7 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.151 -0.477 . . . . 51.44 110.874 179.864 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 62.7 42.97 99.61 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.692 -0.766 . . . . 70.2 112.505 -179.933 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 34.6 p-10 -88.05 -15.98 34.84 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.825 0.345 . . . . 71.3 110.877 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 103.98 2.41 45.58 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.761 -0.733 . . . . 73.13 112.501 -179.935 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -149.15 172.26 15.11 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.829 0.347 . . . . 74.14 110.939 -179.88 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 136' ' ' VAL . . . . . 0.653 HG22 ' HB3' ' A' ' 128' ' ' ALA . 95.6 t -107.8 111.06 34.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.204 -0.453 . . . . 74.2 111.127 179.939 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 44.2 p-10 -92.82 165.95 12.66 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.153 -0.476 . . . . 64.11 110.88 -179.967 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 138' ' ' TYR . . . . . 0.518 ' O ' HG23 ' A' ' 142' ' ' VAL . 58.9 t80 -51.97 -46.47 64.84 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.207 -0.451 . . . . 75.11 110.905 -179.906 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 -51.99 -40.89 61.65 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.113 -0.494 . . . . 72.15 110.867 -179.956 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 20.7 mt-10 -78.34 -39.81 38.36 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.2 -0.455 . . . . 62.44 110.876 -179.926 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 52.4 t80 -61.17 -38.66 87.29 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.15 -0.477 . . . . 74.44 110.87 -179.888 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 142' ' ' VAL . . . . . 0.518 HG23 ' O ' ' A' ' 138' ' ' TYR . 93.8 t -71.26 -37.95 68.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.119 -0.491 . . . . 54.44 111.11 179.961 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 3.4 tp-100 -71.56 -31.25 66.79 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.185 -0.461 . . . . 54.21 110.895 -179.955 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 9.0 tpt -74.7 -42.43 58.39 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.193 -0.458 . . . . 73.54 110.867 179.964 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 9.6 ttm -79.34 -26.07 42.19 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.236 -0.438 . . . . 71.34 110.875 179.967 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 2.6 m . . . . . 0 C--N 1.329 -0.291 0 CA-C-N 116.23 -0.441 . . . . 62.21 111.14 -179.924 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' M' M ' 15' ' ' LYS . . . . . . . . . . . . . 60.9 mttp . . . . . 0 C--O 1.231 0.081 0 CA-C-O 120.744 0.307 . . . . 73.23 110.894 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' M' M ' 16' ' ' TRP . . . . . 0.468 ' CE3' HD12 ' M' ' 19' ' ' ILE . 19.7 m95 -54.34 -39.31 66.96 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.244 -0.434 . . . . 71.45 110.862 179.983 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' M' M ' 17' ' ' GLU . . . . . . . . . . . . . 41.0 tp10 -56.45 -26.81 54.97 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.243 -0.435 . . . . 62.42 110.883 -179.974 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' M' M ' 18' ' ' LYS . . . . . . . . . . . . . 6.9 ttpm? -78.61 -25.87 45.21 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.171 -0.468 . . . . 73.21 110.897 179.984 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' M' M ' 19' ' ' ILE . . . . . 0.468 HD12 ' CE3' ' M' ' 16' ' ' TRP . 29.6 mt -89.88 -25.22 5.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.187 -0.46 . . . . 71.11 111.14 179.874 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' M' M ' 20' ' ' ARG . . . . . . . . . . . . . 22.5 ttt180 . . . . . 0 C--N 1.329 -0.303 0 CA-C-N 116.174 -0.466 . . . . 73.44 110.903 179.956 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' M' M ' 30' ' ' LYS . . . . . . . . . . . . . 3.0 ttmm . . . . . 0 C--O 1.232 0.136 0 CA-C-O 120.783 0.325 . . . . 74.24 110.892 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' M' M ' 31' ' ' LEU . . . . . 0.434 HD21 HD13 ' A' ' 63' ' ' ILE . 9.5 tp -127.33 -52.28 1.39 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.196 -0.456 . . . . 75.44 110.933 179.926 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' M' M ' 32' ' ' LYS . . . . . . . . . . . . . 3.2 ttpp -47.65 -47.08 29.41 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.212 -0.449 . . . . 63.54 110.918 179.792 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' M' M ' 33' ' ' HIS . . . . . . . . . . . . . 74.8 t60 -50.45 -39.87 48.93 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.201 -0.454 . . . . 70.11 110.838 179.924 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' M' M ' 34' ' ' ILE . . . . . . . . . . . . . 50.1 mt -50.73 -39.27 18.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.236 -0.438 . . . . 65.42 111.123 -180.0 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' M' M ' 35' ' ' VAL . . . . . . . . . . . . . 61.1 t -49.27 -39.93 13.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.194 -0.457 . . . . 75.52 111.098 179.895 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' M' M ' 36' ' ' TRP . . . . . . . . . . . . . 22.8 m0 -59.02 -39.5 82.12 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.168 -0.469 . . . . 71.51 110.95 179.958 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' M' M ' 37' ' ' ALA . . . . . 0.98 ' HB3' HD13 ' A' ' 39' ' ' LEU . . . -63.71 -18.69 64.28 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.205 -0.452 . . . . 74.25 111.069 179.874 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' M' M ' 38' ' ' SER . . . . . 0.64 ' HB3' HD23 ' A' ' 18' ' ' LEU . 1.2 m -69.3 -17.96 63.78 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.24 -0.436 . . . . 72.5 110.871 -179.769 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' M' M ' 39' ' ' ARG . . . . . . . . . . . . . 26.4 ptt180 -56.11 -25.38 45.64 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.107 -0.497 . . . . 74.15 110.877 -179.916 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' M' M ' 40' ' ' GLU . . . . . . . . . . . . . 41.6 mm-40 -88.1 -47.99 8.07 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.188 -0.46 . . . . 42.34 110.914 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' M' M ' 41' ' ' LEU . . . . . . . . . . . . . 12.9 mt . . . . . 0 C--N 1.328 -0.34 0 CA-C-N 116.165 -0.47 . . . . 70.31 110.97 179.956 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 8.0 tp60 . . . . . 0 C--O 1.231 0.118 0 CA-C-O 120.784 0.326 . . . . 71.03 110.908 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 59.4 mt -72.56 -38.39 59.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.199 -0.455 . . . . 72.22 111.088 179.989 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -65.91 -27.02 67.88 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.228 -0.442 . . . . 54.31 111.137 179.807 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 20.6 mm-40 -74.83 -44.75 47.56 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.173 -0.467 . . . . 65.23 110.9 -179.933 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 23.8 m-85 -75.26 -45.81 37.68 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.157 -0.474 . . . . 61.02 110.853 -179.913 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 27.0 ttmt -56.36 -44.53 80.2 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.149 -0.478 . . . . 73.34 110.888 179.976 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -52.99 -32.65 47.61 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.202 -0.454 . . . . 72.4 110.84 -179.993 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -67.51 -42.2 83.23 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.193 -0.458 . . . . 72.04 111.109 179.916 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 66.6 t80 -56.07 -53.51 56.18 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.199 -0.455 . . . . 61.32 110.899 -179.914 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 70.9 m -55.85 -27.21 50.54 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.141 -0.481 . . . . 41.23 110.855 -179.796 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 15.5 tp -67.77 -40.25 84.04 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.182 -0.463 . . . . 71.35 110.947 179.964 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.672 ' HA ' HG21 ' A' ' 35' ' ' VAL . 59.5 m-85 -82.43 -34.48 28.2 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.228 -0.442 . . . . 75.11 110.853 179.93 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 11.0 t0 -69.47 98.52 1.12 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.192 -0.458 . . . . 64.21 110.859 -179.999 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 45.4 mmtt -72.09 -56.14 6.12 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.169 -0.469 . . . . 63.24 110.869 -179.978 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 26.5 p-10 -73.94 -10.01 59.22 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.2 -0.455 . . . . 53.41 110.876 179.893 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 51.99 44.6 56.41 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.762 -0.732 . . . . 74.13 112.529 -179.9 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 26.5 p-10 -88.51 -15.77 34.41 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.878 0.371 . . . . 72.53 110.89 -179.979 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 104.67 -11.72 50.08 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.74 -0.743 . . . . 72.02 112.47 -179.953 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 20.7 p -131.04 130.68 43.58 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.715 0.293 . . . . 74.31 111.166 -179.851 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 21.2 mt -90.47 130.84 39.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.292 -0.413 . . . . 62.44 111.096 179.919 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 29.8 p -108.75 -176.83 3.15 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.188 -0.46 . . . . 73.13 111.141 179.963 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.512 HG23 HD12 ' A' ' 52' ' ' ILE . 7.6 p -65.61 -41.5 92.69 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.247 -0.433 . . . . 73.21 111.126 -179.985 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 79.8 mttt -68.23 -50.15 55.91 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.206 -0.452 . . . . 73.15 110.902 179.935 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 27.4 mt-10 -56.36 -32.65 64.94 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.187 -0.461 . . . . 72.04 110.882 179.992 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.559 HD13 ' O ' ' A' ' 32' ' ' LEU . 0.9 OUTLIER -73.13 -43.14 62.07 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.156 -0.475 . . . . 50.23 110.926 179.988 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -69.73 -27.86 72.77 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.742 -0.742 . . . . 73.22 112.448 179.933 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 46.6 m -64.68 -59.51 4.18 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.841 0.353 . . . . 42.13 111.177 -179.896 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.672 HG21 ' HA ' ' A' ' 19' ' ' PHE . 99.9 t -57.38 -50.35 77.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.233 -0.439 . . . . 64.43 111.169 179.864 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 1.9 ttt -55.08 -30.42 59.63 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.166 -0.47 . . . . 75.11 110.907 179.88 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 23.9 ttm180 -60.1 -50.67 72.8 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.223 -0.444 . . . . 73.53 110.9 -179.96 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' SER . . . . . 0.587 ' OG ' HD21 ' M' ' 41' ' ' LEU . 1.6 t -61.34 -26.17 67.64 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.16 -0.473 . . . . 63.04 110.853 -179.751 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 1.0 HD13 ' HB3' ' M' ' 37' ' ' ALA . 58.2 mt -73.84 -20.5 60.42 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.096 -0.502 . . . . 71.15 110.93 179.963 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 101.5 29.62 6.21 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.715 -0.755 . . . . 75.23 112.467 179.886 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 10.5 mm-40 -127.46 133.97 49.87 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.796 0.331 . . . . 73.12 110.918 -179.882 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 10.7 t-20 -109.27 86.24 4.03 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.609 0.718 . . . . 70.13 110.875 -179.984 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.78 167.89 23.16 Favored 'Trans proline' 0 C--O 1.231 0.167 0 C-N-CA 122.709 2.272 . . . . 75.03 112.306 179.934 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 19.3 p -111.79 156.49 21.89 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.187 -0.461 . . . . 54.24 111.152 179.997 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 12.3 tp10 -51.97 -40.81 61.47 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.244 -0.435 . . . . 74.23 110.882 179.973 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.32 -39.37 65.33 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.159 -0.473 . . . . 40.04 111.109 179.943 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -60.47 -52.58 64.58 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.258 -0.428 . . . . 71.04 110.886 -179.924 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.43 ' CD2' HD12 ' A' ' 32' ' ' LEU . 19.7 mt -55.27 -48.52 73.89 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.163 -0.471 . . . . 74.22 110.89 -179.956 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.84 -41.94 71.33 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.196 -0.456 . . . . 40.02 110.894 179.977 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 51.0 t0 -57.99 -43.2 86.45 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.175 -0.466 . . . . 72.04 110.878 179.949 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 5.8 mtp -62.9 -55.36 26.75 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.205 -0.452 . . . . 72.33 110.873 179.989 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.512 HD12 HG23 ' A' ' 29' ' ' THR . 65.5 mt -53.24 -53.66 22.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.201 -0.454 . . . . 75.23 111.144 179.95 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 53' ' ' ASN . . . . . 0.403 HD21 ' HA ' ' A' ' 53' ' ' ASN . 0.2 OUTLIER -61.73 -37.67 85.06 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.203 -0.453 . . . . 71.22 110.88 179.936 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 -60.02 -33.16 71.64 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.163 -0.471 . . . . 72.31 110.914 179.986 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.489 HG11 ' SD ' ' A' ' 71' ' ' MET . 32.8 m -109.97 20.2 6.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.126 -0.488 . . . . 71.31 111.141 179.95 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 29.3 t0 -90.11 99.15 12.22 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.157 -0.474 . . . . 63.3 110.83 179.947 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.35 -40.19 13.76 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.163 -0.471 . . . . 63.43 111.071 179.956 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 13.0 p-10 -86.64 -0.12 55.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.235 -0.439 . . . . 74.42 110.859 179.981 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 52.46 56.81 15.8 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.738 -0.744 . . . . 71.21 112.504 -179.911 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 52.1 p-10 -114.48 -15.89 11.99 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.877 0.37 . . . . 71.12 110.921 -179.93 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' GLY . . . . . 0.498 ' O ' HG21 ' A' ' 52' ' ' ILE . . . 91.65 17.79 47.38 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.695 -0.764 . . . . 64.21 112.445 179.981 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 25.1 p -150.49 162.38 40.71 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.721 0.296 . . . . 75.24 111.168 -179.814 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.419 HG21 ' HD1' ' A' ' 68' ' ' PHE . 20.3 mt -97.86 109.39 23.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.242 -0.435 . . . . 74.11 111.121 179.941 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -75.84 -172.69 2.01 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.218 -0.447 . . . . 73.43 110.864 179.878 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.535 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 2.5 t80 -64.91 -58.15 13.77 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.644 0.735 . . . . 74.54 110.909 -179.948 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 66' ' ' PRO . . . . . 0.535 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 54.3 Cg_endo -69.71 -27.83 26.25 Favored 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.669 2.246 . . . . 51.32 112.364 179.977 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 14.0 mt-10 -59.75 -41.06 90.13 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.221 -0.445 . . . . 73.24 110.864 -179.939 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' PHE . . . . . 0.419 ' HD1' HG21 ' A' ' 63' ' ' ILE . 24.0 t80 -73.99 -36.11 64.49 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.164 -0.471 . . . . 63.31 110.924 -179.982 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 24.0 tp -68.14 -53.89 21.92 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.141 -0.481 . . . . 74.42 110.921 -179.987 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 14.8 t -54.92 -30.85 59.47 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.2 -0.455 . . . . 64.23 111.124 179.972 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' MET . . . . . 0.489 ' SD ' HG11 ' A' ' 55' ' ' VAL . 44.1 ttp -58.94 -38.3 78.69 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.216 -0.447 . . . . 73.42 110.86 179.919 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -75.65 -36.66 60.09 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.214 -0.448 . . . . 63.14 110.884 179.965 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.296 0 CA-C-N 116.224 -0.444 . . . . 70.13 111.085 179.92 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 76.5 mt . . . . . 0 N--CA 1.458 -0.071 0 CA-C-O 120.807 0.336 . . . . 55.34 111.11 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 25.9 ttt85 -71.44 -42.27 68.43 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.138 -0.483 . . . . 73.44 110.859 179.962 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.742 ' O ' HG23 ' A' ' 91' ' ' VAL . 18.0 tt0 -62.31 -56.93 13.67 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.215 -0.448 . . . . 61.14 110.89 -179.896 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 88' ' ' ALA . . . . . 0.469 ' HB1' ' CE2' ' A' ' 92' ' ' PHE . . . -53.35 -51.03 63.75 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.152 -0.476 . . . . 74.21 111.082 179.935 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 17.1 t80 -53.16 -43.41 67.03 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.2 -0.455 . . . . 73.14 110.933 -179.928 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 59.6 ttp180 -69.19 -34.29 74.69 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.127 -0.488 . . . . 72.13 110.846 -179.886 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 91' ' ' VAL . . . . . 0.742 HG23 ' O ' ' A' ' 87' ' ' GLU . 96.1 t -66.07 -40.73 88.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.139 -0.482 . . . . 74.1 111.167 179.967 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.469 ' CE2' ' HB1' ' A' ' 88' ' ' ALA . 8.3 m-85 -76.81 -31.92 57.27 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.129 -0.487 . . . . 75.13 110.843 -179.972 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 21.5 t0 -71.29 85.4 0.79 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.158 -0.473 . . . . 54.32 110.869 -180.0 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 11.5 ptpt -78.72 -40.58 33.25 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.175 -0.466 . . . . 74.33 110.876 -179.995 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 55.2 p-10 -75.01 -9.17 58.28 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.202 -0.454 . . . . 60.43 110.842 179.883 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 59.55 26.81 62.72 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.74 -0.743 . . . . 71.34 112.504 -179.885 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 35.8 p-10 -84.22 -16.13 44.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.879 0.371 . . . . 71.34 110.888 -179.901 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 80.98 18.26 70.25 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.744 -0.741 . . . . 70.55 112.482 -179.996 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 20.7 m-85 -140.83 142.24 34.61 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.84 0.352 . . . . 72.14 110.948 -179.789 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 62.3 mt -103.48 126.44 57.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.172 -0.467 . . . . 75.11 111.12 179.913 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 93.0 p -107.28 -175.63 2.84 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.193 -0.458 . . . . 70.4 110.896 -179.942 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 102' ' ' ALA . . . . . 0.66 ' O ' HG11 ' A' ' 121' ' ' VAL . . . -73.27 -31.56 64.16 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.115 -0.493 . . . . 74.21 111.088 179.928 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -71.07 -47.08 60.41 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.234 -0.439 . . . . 72.12 111.087 179.935 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 104' ' ' GLU . . . . . 0.43 ' O ' HG23 ' A' ' 108' ' ' VAL . 69.9 mt-10 -69.16 -44.02 73.12 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.254 -0.43 . . . . 75.51 110.917 -179.914 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 35.8 tp -53.42 -42.32 66.94 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.104 -0.498 . . . . 62.53 110.928 -179.989 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 106' ' ' ARG . . . . . 0.605 ' HB2' HG21 ' A' ' 121' ' ' VAL . 8.9 ttt-85 -63.98 -49.33 72.94 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.223 -0.444 . . . . 73.53 110.858 179.975 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 18.9 t60 -54.22 -34.39 60.52 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.212 -0.449 . . . . 61.35 110.877 179.951 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.43 HG23 ' O ' ' A' ' 104' ' ' GLU . 95.2 t -73.34 -29.98 29.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.194 -0.457 . . . . 71.21 111.098 179.995 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 44.4 tpp -73.29 -53.76 10.06 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.226 -0.443 . . . . 63.14 110.884 179.939 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 2.1 t -51.75 -30.18 21.66 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.198 -0.455 . . . . 75.44 111.13 -179.923 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 6.7 m120 -65.06 -37.45 87.6 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.2 -0.455 . . . . 55.43 110.932 179.979 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 17.3 mt -72.12 -9.72 58.8 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.182 -0.463 . . . . 62.13 110.916 179.919 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 101.08 29.18 6.53 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.736 -0.745 . . . . 74.44 112.503 179.923 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 12.4 tp10 -133.01 110.06 9.98 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.953 0.406 . . . . 72.44 110.885 -179.907 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 31.0 tttt -85.69 120.42 27.1 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.133 -0.485 . . . . 73.32 110.879 179.96 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.801 HD22 ' HG2' ' A' ' 120' ' ' GLU . 61.1 mt -124.54 153.58 41.9 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.191 -0.459 . . . . 74.32 110.921 179.895 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 45.5 p -89.55 162.83 15.47 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.18 -0.464 . . . . 65.22 111.154 179.964 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 94.7 m-20 -53.56 -38.78 64.19 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.206 -0.452 . . . . 41.41 110.882 179.935 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -68.23 -34.3 75.98 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.186 -0.461 . . . . 73.22 110.92 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 120' ' ' GLU . . . . . 0.801 ' HG2' HD22 ' A' ' 116' ' ' LEU . 19.9 tp10 -67.12 -42.3 84.75 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.117 -0.492 . . . . 73.22 110.902 -179.962 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.66 HG11 ' O ' ' A' ' 102' ' ' ALA . 63.6 t -60.34 -34.54 57.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.124 -0.489 . . . . 64.41 111.127 179.976 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -51.95 -46.95 64.95 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.199 -0.455 . . . . 63.13 110.837 179.92 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 35.2 tp10 -57.6 -29.26 64.36 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.214 -0.448 . . . . 75.3 110.867 -179.875 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 35.4 mtp -75.96 -58.06 3.5 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.162 -0.472 . . . . 73.05 110.862 -179.996 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 33.3 mm -54.0 -35.31 28.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.213 -0.449 . . . . 73.31 111.109 179.982 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 51.8 ttm-85 -69.01 -31.72 70.75 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.199 -0.455 . . . . 71.12 110.897 179.952 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -69.01 -40.5 78.65 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.134 -0.485 . . . . 72.55 110.888 -179.944 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.522 ' HB3' HG22 ' A' ' 136' ' ' VAL . . . -83.82 -27.34 28.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.133 -0.485 . . . . 73.33 111.105 179.946 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 50.7 t0 -74.54 86.6 2.09 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.21 -0.45 . . . . 73.34 110.881 179.944 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 90.1 mt -80.08 -45.57 22.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.239 -0.437 . . . . 61.41 111.152 179.966 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 16.6 p30 -71.43 -8.93 57.05 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.152 -0.476 . . . . 54.41 110.83 179.916 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 63.13 43.01 99.33 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.711 -0.756 . . . . 30.42 112.49 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 17.2 p-10 -88.9 -15.91 33.2 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.864 0.364 . . . . 73.3 110.826 -179.934 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 100.36 5.33 54.45 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.721 -0.752 . . . . 63.41 112.434 -179.966 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -149.33 172.16 15.35 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.821 0.343 . . . . 74.42 110.918 -179.823 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 136' ' ' VAL . . . . . 0.522 HG22 ' HB3' ' A' ' 128' ' ' ALA . 98.4 t -113.63 115.97 51.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.234 -0.439 . . . . 65.22 111.097 -179.991 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 45.9 p-10 -93.87 167.83 11.37 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.183 -0.462 . . . . 73.11 110.862 179.978 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 138' ' ' TYR . . . . . 0.709 ' O ' HG23 ' A' ' 142' ' ' VAL . 61.3 t80 -53.2 -41.94 65.8 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.159 -0.473 . . . . 75.13 110.948 -179.958 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 22.9 tp10 -57.11 -40.62 77.43 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.119 -0.491 . . . . 63.14 110.927 180.0 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -78.52 -29.94 46.79 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.088 -0.505 . . . . 75.1 110.859 -179.934 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 53.7 t80 -71.97 -37.1 69.97 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.184 -0.462 . . . . 74.45 110.918 -179.938 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 142' ' ' VAL . . . . . 0.709 HG23 ' O ' ' A' ' 138' ' ' TYR . 85.7 t -64.74 -44.94 96.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.12 -0.491 . . . . 62.12 111.165 179.929 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 42.2 tt0 -63.04 -27.97 69.77 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.161 -0.472 . . . . 63.22 110.906 -179.988 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 3.9 tpt -74.61 -54.96 6.45 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.183 -0.462 . . . . 75.01 110.859 180.0 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 12.8 ttm -65.54 -27.23 68.3 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.217 -0.447 . . . . 60.43 110.871 179.951 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 1.3 m . . . . . 0 C--N 1.329 -0.309 0 CA-C-N 116.243 -0.435 . . . . 63.35 111.149 -179.916 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' M' M ' 15' ' ' LYS . . . . . 0.455 ' CD ' HD11 ' A' ' 116' ' ' LEU . 16.2 mttm . . . . . 0 C--O 1.232 0.157 0 CA-C-O 120.777 0.322 . . . . 73.43 110.904 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' M' M ' 16' ' ' TRP . . . . . . . . . . . . . 34.3 m95 -52.06 -39.08 59.12 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.257 -0.428 . . . . 70.14 110.872 179.977 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' M' M ' 17' ' ' GLU . . . . . . . . . . . . . 17.2 tt0 -55.73 -34.2 64.94 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.255 -0.429 . . . . 71.32 110.89 -179.977 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' M' M ' 18' ' ' LYS . . . . . . . . . . . . . 6.3 ttmm -68.52 -22.18 64.53 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.198 -0.456 . . . . 75.23 110.862 -179.995 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' M' M ' 19' ' ' ILE . . . . . . . . . . . . . 24.2 mm -69.76 -33.61 57.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.192 -0.458 . . . . 50.0 111.119 179.868 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' M' M ' 20' ' ' ARG . . . . . . . . . . . . . 35.0 ttp180 . . . . . 0 C--N 1.329 -0.31 0 CA-C-N 116.194 -0.457 . . . . 73.22 110.871 179.978 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' M' M ' 30' ' ' LYS . . . . . . . . . . . . . 9.2 tttt . . . . . 0 C--O 1.232 0.164 0 CA-C-O 120.785 0.326 . . . . 64.32 110.88 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' M' M ' 31' ' ' LEU . . . . . 0.723 ' CD1' HD12 ' M' ' 34' ' ' ILE . 8.1 tp -96.47 -36.19 10.88 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.279 -0.418 . . . . 74.14 110.914 179.959 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' M' M ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -47.41 -34.4 7.11 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.139 -0.482 . . . . 63.24 110.886 179.855 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' M' M ' 33' ' ' HIS . . . . . . . . . . . . . 3.4 t60 -52.02 -45.78 64.72 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.212 -0.449 . . . . 74.23 110.868 179.926 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' M' M ' 34' ' ' ILE . . . . . 0.723 HD12 ' CD1' ' M' ' 31' ' ' LEU . 60.8 mt -51.82 -35.32 17.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.142 -0.481 . . . . 74.05 111.136 179.97 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' M' M ' 35' ' ' VAL . . . . . . . . . . . . . 46.2 t -49.95 -39.58 15.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.194 -0.457 . . . . 75.41 111.143 179.865 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' M' M ' 36' ' ' TRP . . . . . . . . . . . . . 18.3 m0 -58.79 -39.48 81.18 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.14 -0.482 . . . . 75.24 110.976 179.907 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' M' M ' 37' ' ' ALA . . . . . 1.0 ' HB3' HD13 ' A' ' 39' ' ' LEU . . . -63.85 -18.52 64.24 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.229 -0.441 . . . . 22.11 111.102 179.859 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' M' M ' 38' ' ' SER . . . . . . . . . . . . . 1.4 m -68.75 -17.81 64.11 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.242 -0.435 . . . . 62.03 110.842 -179.765 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' M' M ' 39' ' ' ARG . . . . . . . . . . . . . 51.3 mtp85 -51.73 -29.97 20.62 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.136 -0.484 . . . . 50.43 110.884 -179.968 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' M' M ' 40' ' ' GLU . . . . . . . . . . . . . 28.7 mm-40 -80.07 -47.28 15.09 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.192 -0.458 . . . . 74.32 110.908 -179.939 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' M' M ' 41' ' ' LEU . . . . . 0.587 HD21 ' OG ' ' A' ' 38' ' ' SER . 8.3 mt . . . . . 0 C--N 1.328 -0.34 0 CA-C-N 116.108 -0.496 . . . . 61.04 110.932 -179.984 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 62.0 tp60 . . . . . 0 C--O 1.232 0.163 0 CA-C-O 120.787 0.327 . . . . 74.32 110.932 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 9' ' ' ILE . . . . . 0.408 ' H ' HD12 ' A' ' 9' ' ' ILE . 4.4 mp -71.41 -38.64 69.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.217 -0.447 . . . . 71.25 111.134 179.957 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -53.42 -40.13 64.88 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.154 -0.476 . . . . 75.45 111.127 179.795 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -74.65 -50.48 17.57 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.17 -0.468 . . . . 62.11 110.884 -179.927 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.591 ' CB ' HD13 ' A' ' 69' ' ' LEU . 16.5 m-85 -55.89 -37.62 69.08 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.16 -0.473 . . . . 62.01 110.904 -179.926 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 26.1 tttm -54.63 -37.27 65.43 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.155 -0.475 . . . . 75.31 110.935 179.916 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -68.24 -34.18 75.76 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.239 -0.437 . . . . 74.01 110.889 179.997 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -67.68 -28.21 67.49 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.141 -0.481 . . . . 32.53 111.082 179.934 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 91.0 t80 -75.64 -54.22 7.33 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.251 -0.432 . . . . 73.32 110.863 -179.897 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 9.4 t -54.32 -27.57 36.59 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.209 -0.451 . . . . 72.31 110.812 -179.769 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 16.3 tp -65.18 -38.87 91.89 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.179 -0.464 . . . . 71.13 110.928 -179.992 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.686 ' CD1' HG11 ' A' ' 35' ' ' VAL . 19.8 m-85 -81.46 -24.76 36.59 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.198 -0.455 . . . . 71.24 110.911 179.932 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 11.7 t0 -83.35 98.6 9.55 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.139 -0.482 . . . . 65.12 110.788 179.996 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 21.1 mmmt -67.27 -50.96 58.4 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.16 -0.473 . . . . 74.21 110.907 179.933 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 22.2 p-10 -80.93 -10.16 59.75 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.217 -0.447 . . . . 70.11 110.893 179.86 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 51.64 42.3 51.64 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.746 -0.74 . . . . 74.32 112.481 -179.969 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 34.1 p-10 -88.25 -15.15 36.64 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.838 0.351 . . . . 75.33 110.858 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 105.4 -11.18 47.13 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.711 -0.756 . . . . 33.55 112.502 -179.924 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 7.3 p -127.97 130.75 48.9 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.791 0.329 . . . . 71.5 111.162 -179.882 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.661 HG22 ' HB2' ' A' ' 32' ' ' LEU . 22.0 mt -104.29 109.79 28.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.222 -0.444 . . . . 64.21 111.127 179.913 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.739 HG22 ' CG2' ' A' ' 62' ' ' THR . 20.1 p -95.47 -176.88 3.9 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.173 -0.467 . . . . 43.31 111.144 179.964 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.46 HG22 ' CD1' ' A' ' 52' ' ' ILE . 69.5 p -66.11 -27.45 68.06 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.21 -0.45 . . . . 64.2 111.168 -179.99 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.07 -49.99 17.9 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.172 -0.467 . . . . 62.41 110.928 179.885 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.704 ' O ' HG23 ' A' ' 35' ' ' VAL . 23.8 mt-10 -70.61 -40.15 73.34 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.198 -0.455 . . . . 71.43 110.863 179.967 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.661 ' HB2' HG22 ' A' ' 27' ' ' ILE . 3.8 tt -74.31 -49.69 21.93 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.195 -0.457 . . . . 75.23 110.857 -179.914 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -54.63 -31.5 52.99 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.731 -0.747 . . . . 63.14 112.509 179.905 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 96.3 m -73.38 -47.04 45.33 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.814 0.34 . . . . 64.02 111.125 -179.856 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.704 HG23 ' O ' ' A' ' 31' ' ' GLU . 51.7 t -54.54 -54.34 23.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.229 -0.441 . . . . 75.24 111.151 179.892 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 36' ' ' MET . . . . . 0.524 ' HA ' HD12 ' A' ' 39' ' ' LEU . 8.2 ptm -65.72 -36.73 84.44 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.136 -0.484 . . . . 54.42 110.872 179.932 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 52.4 ttt85 -54.31 -37.31 64.68 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.244 -0.434 . . . . 53.5 110.921 -179.962 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' SER . . . . . 0.585 ' OG ' HD11 ' M' ' 41' ' ' LEU . 0.9 OUTLIER -70.04 -23.63 63.13 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.2 -0.455 . . . . 74.33 110.883 -179.816 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.956 HD13 ' HB3' ' M' ' 37' ' ' ALA . 18.3 mt -85.59 -10.72 55.45 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.121 -0.491 . . . . 73.55 110.919 179.978 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 101.78 22.49 10.14 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.772 -0.728 . . . . 73.03 112.482 179.871 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 3.8 mp0 -121.22 96.81 5.24 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.787 0.327 . . . . 74.14 110.935 -179.891 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 52.5 t30 -109.89 79.34 1.45 Allowed Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.63 0.729 . . . . 71.35 110.908 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.79 168.21 22.25 Favored 'Trans proline' 0 C--O 1.232 0.205 0 C-N-CA 122.685 2.256 . . . . 71.12 112.344 179.964 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 24.7 p -79.22 159.9 27.13 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.224 -0.444 . . . . 63.22 111.146 -179.969 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -51.66 -45.72 63.49 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.197 -0.456 . . . . 73.44 110.88 -179.958 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -68.42 -31.39 70.7 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.142 -0.481 . . . . 72.03 111.081 179.969 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 76.9 tt0 -69.7 -44.81 69.65 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.261 -0.427 . . . . 73.11 110.834 -179.922 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 27.3 mt -56.35 -51.88 66.65 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.165 -0.471 . . . . 70.41 110.913 -179.958 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 24.2 tp60 -66.1 -28.03 68.51 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.183 -0.462 . . . . 75.14 110.879 179.958 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 23.4 t0 -56.26 -49.66 73.57 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.183 -0.462 . . . . 60.23 110.845 -179.977 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' MET . . . . . 0.42 ' HE2' ' HB3' ' M' ' 31' ' ' LEU . 8.0 ptp -74.07 -36.91 64.36 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.216 -0.447 . . . . 72.13 110.934 179.953 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.46 ' CD1' HG22 ' A' ' 29' ' ' THR . 91.1 mt -62.55 -38.27 81.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.218 -0.446 . . . . 71.02 111.128 179.966 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 15.1 m-20 -66.61 -24.66 66.35 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.181 -0.463 . . . . 73.33 110.891 179.952 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -76.22 -26.53 56.18 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.129 -0.487 . . . . 71.41 110.875 179.978 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 4.4 m -108.41 8.39 9.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.202 -0.454 . . . . 64.25 111.161 179.956 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 30.8 t0 -82.99 98.39 9.23 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.15 -0.477 . . . . 74.41 110.84 179.936 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.28 -43.02 11.87 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.203 -0.453 . . . . 51.44 111.067 179.961 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 43.5 p30 -84.26 -0.12 51.08 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.191 -0.459 . . . . 70.21 110.882 179.974 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 54.84 54.8 31.13 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.756 -0.735 . . . . 53.31 112.497 -179.933 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 49.7 p-10 -114.56 -15.67 11.97 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.875 0.369 . . . . 75.23 110.893 -179.869 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 94.16 18.56 36.21 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.744 -0.741 . . . . 53.13 112.527 179.994 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' THR . . . . . 0.739 ' CG2' HG22 ' A' ' 28' ' ' THR . 20.4 p -145.62 175.52 10.3 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.776 0.322 . . . . 73.4 111.082 -179.844 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.447 HG21 ' HD1' ' A' ' 68' ' ' PHE . 18.9 mt -108.75 110.6 32.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.194 -0.457 . . . . 73.45 111.132 179.922 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.0 t0 -76.02 -172.93 2.15 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.199 -0.455 . . . . 64.23 110.862 179.9 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.521 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 2.4 t80 -64.76 -58.19 13.96 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-O 121.675 0.75 . . . . 61.33 110.893 -179.878 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 66' ' ' PRO . . . . . 0.521 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 54.0 Cg_endo -69.72 -26.8 27.41 Favored 'Trans proline' 0 C--N 1.342 0.208 0 C-N-CA 122.696 2.264 . . . . 65.31 112.331 179.972 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 63.0 mt-10 -61.59 -40.46 94.85 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.232 -0.44 . . . . 71.15 110.918 -179.976 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' PHE . . . . . 0.447 ' HD1' HG21 ' A' ' 63' ' ' ILE . 25.1 t80 -74.44 -35.83 63.37 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.163 -0.471 . . . . 53.43 110.86 -179.93 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.591 HD13 ' CB ' ' A' ' 12' ' ' PHE . 35.3 tp -69.61 -54.06 15.79 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.107 -0.497 . . . . 53.33 110.914 -179.94 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 14.6 t -52.82 -30.38 33.07 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.182 -0.463 . . . . 62.12 111.151 179.966 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' MET . . . . . 0.481 ' HE1' HD11 ' M' ' 31' ' ' LEU . 39.2 ttp -60.4 -51.23 70.36 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.197 -0.456 . . . . 71.44 110.88 179.91 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 5.2 mmt -70.24 -46.03 65.28 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.244 -0.434 . . . . 71.11 110.906 179.956 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.319 0 CA-C-N 116.228 -0.442 . . . . 73.34 111.093 179.912 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.609 HD13 HG13 ' A' ' 142' ' ' VAL . 68.8 mt . . . . . 0 C--O 1.231 0.097 0 CA-C-O 120.788 0.327 . . . . 72.45 111.104 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 34.9 ttm180 -63.41 -28.23 69.84 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.2 -0.455 . . . . 73.25 110.855 179.957 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.719 ' O ' HG23 ' A' ' 91' ' ' VAL . 2.3 mm-40 -63.8 -50.91 67.12 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.245 -0.434 . . . . 62.23 110.84 -179.889 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -66.13 -44.02 85.41 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.195 -0.457 . . . . 75.02 111.1 179.962 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 5.7 t80 -51.97 -48.02 64.55 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.184 -0.462 . . . . 64.01 110.863 -179.921 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 4.3 ttt-85 -63.78 -39.9 95.38 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.157 -0.474 . . . . 72.44 110.864 -179.911 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 91' ' ' VAL . . . . . 0.719 HG23 ' O ' ' A' ' 87' ' ' GLU . 90.4 t -59.37 -33.53 51.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.213 -0.448 . . . . 72.13 111.142 179.982 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.551 ' CE1' HG11 ' A' ' 108' ' ' VAL . 8.6 m-85 -89.98 -26.19 20.49 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.191 -0.458 . . . . 63.31 110.89 -179.986 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 17.1 t0 -73.97 95.6 2.52 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.16 -0.473 . . . . 60.12 110.834 -179.999 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 13.5 mtpt -78.67 -53.25 7.35 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.224 -0.444 . . . . 74.41 110.922 179.963 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 48.9 p30 -73.55 -9.15 58.38 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.239 -0.437 . . . . 73.31 110.909 179.841 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 60.35 31.54 74.26 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.724 -0.75 . . . . 64.54 112.494 -179.92 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 45.6 p-10 -86.24 -16.2 38.42 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.856 0.36 . . . . 75.21 110.879 -179.891 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 89.91 18.73 49.98 Favored Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.69 -0.767 . . . . 62.35 112.492 -179.975 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 14.1 m-85 -134.58 155.68 50.02 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.921 0.391 . . . . 73.12 110.912 -179.839 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 68.5 mt -122.77 121.44 63.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.136 -0.484 . . . . 72.11 111.11 179.957 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 59.7 p -114.59 176.53 5.01 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.172 -0.467 . . . . 70.35 110.872 -179.899 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 102' ' ' ALA . . . . . 0.532 ' HB1' ' CG1' ' A' ' 121' ' ' VAL . . . -66.08 -24.95 66.81 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.133 -0.485 . . . . 71.51 111.113 179.909 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -71.81 -49.91 34.39 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.164 -0.471 . . . . 44.44 111.108 179.949 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -76.63 -47.77 21.21 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.213 -0.449 . . . . 74.34 110.855 -179.877 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.858 HD21 ' HE2' ' A' ' 124' ' ' MET . 23.5 tp -52.95 -50.75 63.43 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.183 -0.462 . . . . 64.44 110.909 -179.974 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 106' ' ' ARG . . . . . 0.484 ' O ' HG23 ' A' ' 110' ' ' THR . 64.2 ttt-85 -52.32 -37.81 56.91 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.199 -0.455 . . . . 73.34 110.897 179.942 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 43.6 t60 -58.93 -34.4 71.7 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.14 -0.482 . . . . 72.24 110.873 179.982 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.551 HG11 ' CE1' ' A' ' 92' ' ' PHE . 21.7 t -74.47 -49.12 32.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.217 -0.447 . . . . 71.01 111.123 179.955 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 109' ' ' MET . . . . . 0.758 ' HA ' HD12 ' A' ' 112' ' ' LEU . 3.9 mmt -64.91 -27.16 68.66 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.185 -0.461 . . . . 74.42 110.894 179.921 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 110' ' ' THR . . . . . 0.484 HG23 ' O ' ' A' ' 106' ' ' ARG . 18.9 p -75.32 -48.3 23.77 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.238 -0.437 . . . . 71.43 111.164 -179.944 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 12.2 t30 -56.61 -26.62 56.13 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.241 -0.436 . . . . 75.31 110.889 179.967 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.758 HD12 ' HA ' ' A' ' 109' ' ' MET . 6.6 mt -70.72 -22.52 62.43 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.184 -0.462 . . . . 72.54 110.92 179.958 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 101.09 33.09 5.06 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.771 -0.728 . . . . 50.15 112.444 179.882 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 24.7 mm-40 -122.28 109.97 15.11 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.899 0.38 . . . . 74.22 110.871 -179.89 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 115' ' ' LYS . . . . . 0.512 ' O ' HD23 ' A' ' 116' ' ' LEU . 28.0 tptt -65.44 137.1 57.23 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.188 -0.46 . . . . 72.43 110.874 179.99 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.583 HD22 ' HG2' ' A' ' 120' ' ' GLU . 48.2 mt -145.76 150.71 36.73 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.209 -0.45 . . . . 65.02 110.914 179.929 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 117' ' ' THR . . . . . 0.714 ' O ' HG23 ' A' ' 121' ' ' VAL . 73.2 p -100.49 170.05 8.65 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.219 -0.446 . . . . 74.14 111.145 179.96 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -53.06 -44.61 67.6 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.25 -0.432 . . . . 74.32 110.845 179.891 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 -70.38 -45.44 66.04 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.239 -0.437 . . . . 74.21 110.884 -179.891 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 120' ' ' GLU . . . . . 0.583 ' HG2' HD22 ' A' ' 116' ' ' LEU . 5.7 tp10 -55.08 -32.18 61.77 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.185 -0.461 . . . . 64.51 110.898 -179.948 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.714 HG23 ' O ' ' A' ' 117' ' ' THR . 73.9 t -69.59 -30.85 46.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.206 -0.452 . . . . 71.44 111.143 179.964 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -78.49 -28.52 46.36 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.12 -0.491 . . . . 72.14 110.878 179.9 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -55.74 -50.01 71.55 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.172 -0.467 . . . . 54.02 110.876 -179.867 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 124' ' ' MET . . . . . 0.858 ' HE2' HD21 ' A' ' 105' ' ' LEU . 12.4 ptm -66.72 -44.31 81.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.167 -0.47 . . . . 71.42 110.929 179.911 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 28.4 mm -53.94 -35.43 28.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.216 -0.447 . . . . 63.0 111.153 179.956 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 23.0 ttp180 -66.8 -31.78 72.63 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.16 -0.473 . . . . 73.14 110.844 179.95 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 10.1 tm-20 -68.83 -40.0 79.68 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.187 -0.461 . . . . 75.42 110.857 -179.928 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.657 ' HB3' HG22 ' A' ' 136' ' ' VAL . . . -82.57 -29.6 30.17 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.178 -0.464 . . . . 63.2 111.105 179.951 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 43.3 t0 -68.39 86.91 0.29 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.23 -0.441 . . . . 73.23 110.915 179.949 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 81.3 mt -79.69 -48.42 20.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.173 -0.467 . . . . 55.33 111.16 -179.955 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 18.7 p30 -73.01 -8.6 56.45 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.157 -0.474 . . . . 72.12 110.835 179.846 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 63.49 43.05 98.72 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.739 -0.743 . . . . 43.24 112.517 -179.915 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 25.8 p-10 -89.53 -15.8 32.13 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.868 0.366 . . . . 65.33 110.856 -179.909 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 102.96 3.51 48.73 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.723 -0.751 . . . . 70.2 112.484 179.993 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -149.14 172.11 15.34 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.852 0.358 . . . . 72.34 110.905 -179.84 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 136' ' ' VAL . . . . . 0.657 HG22 ' HB3' ' A' ' 128' ' ' ALA . 82.7 t -107.67 109.18 27.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.211 -0.45 . . . . 61.31 111.149 179.937 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 20.8 p30 -92.04 164.76 13.49 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.183 -0.462 . . . . 74.02 110.888 -179.978 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 138' ' ' TYR . . . . . 0.614 ' O ' HG23 ' A' ' 142' ' ' VAL . 15.5 t80 -52.3 -45.73 65.66 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.172 -0.467 . . . . 73.44 110.909 -179.868 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -52.01 -40.07 60.42 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.155 -0.475 . . . . 75.24 110.864 -179.986 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 24.2 mt-10 -78.42 -48.47 15.38 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.223 -0.444 . . . . 70.11 110.856 -179.928 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 47.6 t80 -54.17 -40.55 67.59 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.123 -0.489 . . . . 74.14 110.878 -179.916 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 142' ' ' VAL . . . . . 0.614 HG23 ' O ' ' A' ' 138' ' ' TYR . 92.6 t -69.23 -38.77 78.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.138 -0.483 . . . . 73.52 111.145 179.981 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 50.8 tt0 -68.66 -41.23 79.63 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.153 -0.476 . . . . 73.42 110.943 -179.992 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -74.73 -51.81 13.24 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.198 -0.455 . . . . 63.12 110.857 179.979 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 32.9 tpp -51.92 -30.11 22.95 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.209 -0.451 . . . . 54.22 110.929 179.901 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 89.6 m . . . . . 0 C--N 1.329 -0.292 0 CA-C-N 116.236 -0.438 . . . . 65.25 111.133 -179.95 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' M' M ' 15' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.23 0.078 0 CA-C-O 120.798 0.332 . . . . 73.3 110.873 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' M' M ' 16' ' ' TRP . . . . . 0.401 ' CZ3' HD12 ' M' ' 19' ' ' ILE . 32.2 m95 -56.59 -28.13 59.61 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.228 -0.442 . . . . 74.22 110.887 179.947 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' M' M ' 17' ' ' GLU . . . . . . . . . . . . . 9.5 tt0 -54.04 -30.26 47.1 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.267 -0.424 . . . . 73.43 110.916 -179.992 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' M' M ' 18' ' ' LYS . . . . . 0.564 ' CD ' HD13 ' A' ' 112' ' ' LEU . 2.3 ttmp? -60.77 -25.96 66.89 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.132 -0.485 . . . . 62.43 110.878 179.969 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' M' M ' 19' ' ' ILE . . . . . 0.401 HD12 ' CZ3' ' M' ' 16' ' ' TRP . 29.4 mt -103.5 -42.06 7.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.245 -0.434 . . . . 74.35 111.161 179.866 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' M' M ' 20' ' ' ARG . . . . . . . . . . . . . 46.0 ttp180 . . . . . 0 C--N 1.329 -0.308 0 CA-C-N 116.174 -0.466 . . . . 65.45 110.839 -179.969 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' M' M ' 30' ' ' LYS . . . . . . . . . . . . . 5.4 ttmm . . . . . 0 C--O 1.231 0.121 0 CA-C-O 120.831 0.348 . . . . 53.44 110.903 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' M' M ' 31' ' ' LEU . . . . . 0.481 HD11 ' HE1' ' A' ' 71' ' ' MET . 0.8 OUTLIER -118.52 -28.93 5.58 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.195 -0.457 . . . . 64.41 110.908 179.918 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' M' M ' 32' ' ' LYS . . . . . . . . . . . . . 1.8 mttp -48.9 -44.44 40.16 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.184 -0.462 . . . . 45.23 110.875 179.823 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' M' M ' 33' ' ' HIS . . . . . . . . . . . . . 56.5 t-80 -50.26 -39.78 46.05 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.212 -0.449 . . . . 71.22 110.908 179.903 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' M' M ' 34' ' ' ILE . . . . . . . . . . . . . 29.2 mt -50.31 -39.86 17.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.182 -0.463 . . . . 72.2 111.137 179.974 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' M' M ' 35' ' ' VAL . . . . . . . . . . . . . 61.2 t -48.81 -40.71 12.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.204 -0.453 . . . . 55.3 111.096 179.844 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' M' M ' 36' ' ' TRP . . . . . . . . . . . . . 21.4 m0 -59.2 -39.74 83.57 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.214 -0.448 . . . . 74.3 110.916 -179.995 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' M' M ' 37' ' ' ALA . . . . . 0.956 ' HB3' HD13 ' A' ' 39' ' ' LEU . . . -63.21 -18.7 63.8 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.226 -0.443 . . . . 73.42 111.089 179.858 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' M' M ' 38' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -66.29 -18.03 65.11 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.259 -0.428 . . . . 75.21 110.857 -179.792 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' M' M ' 39' ' ' ARG . . . . . . . . . . . . . 12.5 ptt180 -55.62 -25.74 40.45 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.109 -0.496 . . . . 74.35 110.866 -179.946 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' M' M ' 40' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -91.3 -47.97 7.18 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.203 -0.453 . . . . 65.41 110.894 -179.931 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' M' M ' 41' ' ' LEU . . . . . 0.585 HD11 ' OG ' ' A' ' 38' ' ' SER . 10.8 mt . . . . . 0 C--N 1.328 -0.326 0 CA-C-N 116.182 -0.463 . . . . 71.05 110.88 -179.97 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 13.8 tt0 . . . . . 0 C--O 1.232 0.164 0 CA-C-O 120.776 0.322 . . . . 75.4 110.896 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 3.3 mp -65.96 -50.35 70.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.232 -0.44 . . . . 74.23 111.133 179.973 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -56.02 -25.47 44.68 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.189 -0.46 . . . . 71.45 111.12 179.812 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 14.2 tp10 -75.17 -38.39 60.91 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.206 -0.452 . . . . 72.14 110.856 -179.948 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.45 ' CB ' HD13 ' A' ' 69' ' ' LEU . 54.2 m-85 -76.28 -46.13 29.32 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.175 -0.466 . . . . 73.42 110.911 -179.908 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 7.8 ptmm? -57.25 -29.39 63.77 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.183 -0.462 . . . . 70.41 110.919 179.945 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -66.82 -37.54 84.72 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.194 -0.457 . . . . 74.04 110.889 179.939 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -67.03 -37.17 83.64 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.159 -0.473 . . . . 71.41 111.089 179.934 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 77.4 t80 -59.45 -54.31 48.14 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.227 -0.442 . . . . 64.54 110.878 -179.895 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 41.5 t -56.3 -28.13 57.77 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.118 -0.492 . . . . 71.33 110.833 -179.767 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 15.5 tp -65.5 -40.79 93.47 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.138 -0.483 . . . . 73.43 110.894 -179.985 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.55 ' HA ' HG21 ' A' ' 35' ' ' VAL . 43.1 m-85 -80.49 -24.67 39.26 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.2 -0.454 . . . . 61.21 110.858 179.973 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 9.8 t0 -79.44 98.61 6.85 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.165 -0.471 . . . . 75.0 110.849 179.998 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.68 -47.06 82.74 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.193 -0.458 . . . . 64.5 110.816 -179.966 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 24.4 p-10 -86.89 -10.21 53.89 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.246 -0.434 . . . . 72.25 110.905 179.894 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 51.41 46.23 52.63 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.728 -0.749 . . . . 75.0 112.49 -179.953 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 29.5 p-10 -88.73 -14.06 38.13 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.843 0.354 . . . . 72.55 110.89 -179.984 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 105.35 13.41 24.66 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.788 -0.72 . . . . 53.54 112.491 -179.95 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 1.4 p -154.65 142.26 19.82 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.772 0.32 . . . . 54.14 111.108 -179.872 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 25.1 mt -101.84 124.99 56.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.209 -0.45 . . . . 75.1 111.102 179.943 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.552 HG22 ' CG2' ' A' ' 62' ' ' THR . 39.5 p -110.05 174.83 5.68 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.188 -0.46 . . . . 71.24 111.141 179.929 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.737 HG22 HD12 ' A' ' 52' ' ' ILE . 61.0 p -61.07 -31.89 71.54 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.178 -0.464 . . . . 72.5 111.134 179.993 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.84 -49.93 12.11 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.224 -0.444 . . . . 71.1 110.906 179.937 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 23.3 mt-10 -61.26 -33.62 73.84 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.211 -0.45 . . . . 63.54 110.908 179.958 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.1 tt -74.24 -55.11 6.43 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.12 -0.491 . . . . 71.24 110.926 -179.994 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -52.22 -27.87 24.98 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.747 -0.74 . . . . 73.42 112.461 179.948 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 54.8 m -63.69 -59.18 4.92 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.797 0.332 . . . . 73.22 111.12 -179.861 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.55 HG21 ' HA ' ' A' ' 19' ' ' PHE . 36.3 t -52.62 -49.29 45.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.208 -0.451 . . . . 73.21 111.09 179.957 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 28.2 mtp -51.83 -35.79 45.75 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.186 -0.461 . . . . 55.43 110.907 179.904 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 24.5 ttp180 -55.73 -51.88 65.84 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.199 -0.455 . . . . 74.12 110.891 -179.942 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' SER . . . . . 0.636 ' OG ' HD21 ' M' ' 41' ' ' LEU . 3.8 t -66.45 -28.5 68.65 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.179 -0.464 . . . . 75.12 110.87 -179.816 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.963 HD13 ' HB3' ' M' ' 37' ' ' ALA . 57.6 mt -77.14 -24.3 51.62 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.111 -0.495 . . . . 72.4 110.924 179.963 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 101.35 32.8 5.08 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.756 -0.735 . . . . 54.02 112.477 179.89 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 17.6 mm-40 -131.09 105.42 7.7 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.853 0.358 . . . . 65.01 110.897 -179.874 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 59.9 t30 -109.86 76.93 1.01 Allowed Pre-proline 0 C--N 1.33 -0.282 0 CA-C-O 121.619 0.723 . . . . 71.44 110.878 -179.948 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.83 168.01 22.88 Favored 'Trans proline' 0 C--O 1.231 0.162 0 C-N-CA 122.67 2.247 . . . . 62.32 112.315 179.965 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 76.7 p -86.95 157.53 19.47 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.209 -0.45 . . . . 72.43 111.14 -179.958 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -52.28 -39.22 60.17 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.233 -0.44 . . . . 74.34 110.88 179.984 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -72.13 -32.96 67.41 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.203 -0.453 . . . . 64.22 111.092 179.946 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 10.1 tt0 -69.7 -49.71 50.79 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.191 -0.458 . . . . 75.22 110.886 -179.916 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 34.1 mt -55.14 -43.08 73.84 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.163 -0.471 . . . . 50.53 110.885 -179.955 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -56.42 -33.63 66.01 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.151 -0.477 . . . . 64.34 110.895 179.951 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -70.18 -37.52 75.16 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.233 -0.439 . . . . 72.3 110.863 179.988 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 39.6 mtp -65.22 -57.84 7.49 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.204 -0.453 . . . . 72.33 110.88 -179.994 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.737 HD12 HG22 ' A' ' 29' ' ' THR . 62.4 mt -57.61 -42.64 81.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.21 -0.45 . . . . 55.24 111.167 179.96 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 48.6 m-20 -59.28 -37.19 77.03 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.146 -0.479 . . . . 72.41 110.842 179.936 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -65.69 -29.87 70.48 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.209 -0.451 . . . . 73.23 110.88 -179.993 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 14.7 m -103.15 6.64 10.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.144 -0.48 . . . . 75.4 111.142 179.979 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 31.3 t0 -90.11 96.63 10.76 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.125 -0.489 . . . . 74.04 110.869 179.927 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.18 -42.0 12.61 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.184 -0.462 . . . . 70.03 111.118 179.956 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -85.02 0.01 52.9 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.234 -0.439 . . . . 43.3 110.849 179.99 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 55.03 57.98 15.81 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.754 -0.736 . . . . 74.34 112.519 -179.924 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 52.2 p-10 -114.6 -15.7 11.95 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.871 0.367 . . . . 72.44 110.92 -179.917 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 90.06 16.91 55.18 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.738 -0.744 . . . . 63.13 112.446 179.917 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' THR . . . . . 0.552 ' CG2' HG22 ' A' ' 28' ' ' THR . 46.9 p -151.35 162.85 40.2 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.735 0.302 . . . . 73.1 111.158 -179.846 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 19.9 mt -96.94 116.99 40.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.184 -0.462 . . . . 74.14 111.124 179.921 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.4 t0 -81.12 -172.95 4.02 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.199 -0.455 . . . . 74.0 110.864 179.865 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.519 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 2.5 t80 -64.93 -58.4 12.96 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.64 0.733 . . . . 74.54 110.92 -179.932 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 66' ' ' PRO . . . . . 0.519 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 54.1 Cg_endo -69.76 -28.73 24.89 Favored 'Trans proline' 0 C--N 1.341 0.158 0 C-N-CA 122.681 2.254 . . . . 72.32 112.379 179.937 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 23.8 mt-10 -58.24 -45.45 87.73 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.218 -0.447 . . . . 63.34 110.88 179.992 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 13.2 t80 -71.37 -36.43 71.44 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.149 -0.478 . . . . 72.44 110.892 -179.948 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.45 HD13 ' CB ' ' A' ' 12' ' ' PHE . 15.3 tp -64.09 -53.7 45.63 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.169 -0.469 . . . . 74.04 110.922 -179.972 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 14.8 t -61.26 -29.46 69.86 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.189 -0.46 . . . . 75.22 111.153 179.94 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 5.6 tmm? -63.31 -43.83 96.72 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.223 -0.444 . . . . 74.53 110.885 179.902 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -79.49 -30.01 41.85 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.223 -0.444 . . . . 73.31 110.864 179.984 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.257 0 CA-C-N 116.238 -0.437 . . . . 71.35 111.09 179.924 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.94 HG21 HG22 ' A' ' 142' ' ' VAL . 49.8 mt . . . . . 0 N--CA 1.457 -0.106 0 CA-C-O 120.853 0.359 . . . . 74.55 111.135 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 2.2 tpm_? -70.78 -53.58 14.91 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.15 -0.477 . . . . 74.41 110.855 179.974 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.722 ' O ' HG23 ' A' ' 91' ' ' VAL . 1.6 pp20? -60.44 -39.87 89.06 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.18 -0.463 . . . . 65.45 110.894 -179.933 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -59.58 -48.51 81.39 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.148 -0.478 . . . . 51.23 111.086 179.946 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 9.1 t80 -52.08 -44.93 64.59 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.27 -0.423 . . . . 74.24 110.841 -179.87 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 6.5 tpt180 -66.38 -40.77 89.9 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.178 -0.464 . . . . 73.15 110.858 -179.91 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 91' ' ' VAL . . . . . 0.722 HG23 ' O ' ' A' ' 87' ' ' GLU . 92.4 t -58.4 -33.85 48.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.202 -0.454 . . . . 71.42 111.153 179.981 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 9.9 m-85 -87.52 -36.86 17.37 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.161 -0.472 . . . . 72.15 110.874 -180.0 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 17.6 t0 -61.3 96.05 0.05 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.151 -0.477 . . . . 64.24 110.847 -179.979 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 7.2 mtmp? -78.63 -52.55 8.28 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.16 -0.473 . . . . 74.21 110.924 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 32.7 p30 -75.45 -9.14 58.31 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.253 -0.431 . . . . 73.51 110.872 179.855 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 60.61 31.9 76.55 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.758 -0.734 . . . . 64.21 112.46 -179.972 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 48.6 p-10 -83.13 -16.1 48.09 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.879 0.371 . . . . 73.52 110.909 -179.931 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 86.72 18.7 57.9 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.77 -0.728 . . . . 73.51 112.489 179.99 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 6.4 m-85 -137.52 147.89 45.56 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.851 0.358 . . . . 64.11 110.942 -179.853 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 62.3 mt -112.7 112.9 42.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.117 -0.492 . . . . 74.13 111.111 179.919 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 52.0 p -107.05 -174.23 2.48 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.139 -0.482 . . . . 72.05 110.847 -179.915 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 102' ' ' ALA . . . . . 0.539 ' HB1' ' CG1' ' A' ' 121' ' ' VAL . . . -67.71 -32.25 72.76 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.112 -0.495 . . . . 71.21 111.086 179.927 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -69.88 -45.33 67.91 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.18 -0.464 . . . . 72.13 111.098 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 18.4 mt-10 -75.32 -51.24 13.66 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.197 -0.456 . . . . 72.03 110.89 -179.942 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 47.2 tp -53.48 -43.28 68.05 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.157 -0.474 . . . . 63.02 110.925 -179.982 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 56.1 ttp180 -56.21 -49.39 74.22 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.224 -0.444 . . . . 71.32 110.903 179.931 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 80.0 t60 -54.44 -34.92 62.36 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.21 -0.45 . . . . 75.52 110.841 -179.995 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 81.0 t -67.02 -46.2 85.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.201 -0.454 . . . . 75.0 111.16 179.93 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 109' ' ' MET . . . . . 0.415 ' HE1' ' HB2' ' M' ' 15' ' ' LYS . 3.3 mmt -69.47 -25.14 63.93 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.133 -0.485 . . . . 63.44 110.885 179.923 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 7.4 m -74.12 -56.26 5.13 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.185 -0.461 . . . . 71.1 111.132 -179.891 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 6.4 t-20 -56.75 -26.79 58.21 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.234 -0.439 . . . . 73.21 110.849 -179.984 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 19.3 mt -70.74 -22.25 62.44 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.178 -0.464 . . . . 73.34 110.914 179.987 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 101.09 33.02 5.08 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.757 -0.735 . . . . 71.42 112.467 179.859 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 24.7 tp10 -110.25 163.24 13.83 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.928 0.394 . . . . 73.12 110.901 -179.889 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 115' ' ' LYS . . . . . 0.493 ' O ' HD23 ' A' ' 116' ' ' LEU . 48.0 mttp -116.92 103.57 10.42 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.19 -0.459 . . . . 74.01 110.904 179.958 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.621 HD22 ' HG2' ' A' ' 120' ' ' GLU . 17.9 mt -131.25 113.22 13.55 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.183 -0.462 . . . . 73.31 110.9 179.932 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 34.3 p -72.04 172.72 9.56 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.169 -0.469 . . . . 73.44 111.133 179.951 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 69.1 m-20 -51.91 -38.14 55.13 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.184 -0.462 . . . . 73.44 110.895 179.908 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 50.4 tp10 -71.7 -35.99 70.41 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.189 -0.46 . . . . 74.14 110.891 -179.901 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 120' ' ' GLU . . . . . 0.621 ' HG2' HD22 ' A' ' 116' ' ' LEU . 2.0 tt0 -63.55 -40.0 95.87 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.153 -0.476 . . . . 74.31 110.872 -179.93 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.539 ' CG1' ' HB1' ' A' ' 102' ' ' ALA . 60.1 t -62.72 -43.68 98.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.179 -0.464 . . . . 72.33 111.107 -179.965 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 39.8 t0 -57.06 -55.13 38.7 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.19 -0.459 . . . . 64.15 110.851 179.906 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 10.9 tm-20 -56.25 -29.28 60.86 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.157 -0.474 . . . . 72.04 110.887 -179.893 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 124' ' ' MET . . . . . 0.462 ' HE1' HD11 ' M' ' 19' ' ' ILE . 24.6 ttt -68.01 -59.95 2.87 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.146 -0.479 . . . . 64.33 110.853 -179.965 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.501 HG23 HG23 ' A' ' 136' ' ' VAL . 31.4 mm -53.98 -35.78 29.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.235 -0.439 . . . . 72.42 111.092 179.98 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 31.6 ttp180 -61.12 -31.73 71.42 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.2 -0.454 . . . . 64.42 110.914 179.949 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 11.8 tm-20 -72.23 -46.27 56.76 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.185 -0.461 . . . . 75.35 110.881 -179.943 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.642 ' HB3' HG22 ' A' ' 136' ' ' VAL . . . -73.37 -25.52 60.62 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.173 -0.467 . . . . 70.52 111.101 179.938 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 38.8 t0 -68.07 87.34 0.27 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.205 -0.452 . . . . 73.13 110.878 179.975 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 70.5 mt -79.91 -48.12 20.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.195 -0.457 . . . . 62.2 111.151 179.988 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 18.9 p30 -75.1 -8.65 57.14 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.183 -0.462 . . . . 75.43 110.847 179.869 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 63.99 45.18 94.64 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.742 -0.742 . . . . 54.13 112.522 -179.884 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 35.3 p-10 -92.21 -15.84 27.01 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.867 0.365 . . . . 74.55 110.882 -179.977 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 103.46 2.83 47.36 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.772 -0.728 . . . . 33.21 112.522 -179.931 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -149.22 172.23 15.18 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.871 0.367 . . . . 75.23 110.952 -179.926 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 136' ' ' VAL . . . . . 0.642 HG22 ' HB3' ' A' ' 128' ' ' ALA . 49.1 t -108.49 113.25 43.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.21 -0.45 . . . . 45.55 111.132 179.98 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 16.3 p30 -93.17 172.1 8.52 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.159 -0.473 . . . . 75.04 110.924 179.997 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 88.6 t80 -54.91 -47.33 74.49 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.212 -0.449 . . . . 74.43 110.962 -179.922 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 25.1 tt0 -51.96 -49.72 62.63 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.094 -0.503 . . . . 74.34 110.886 -179.979 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 14.7 mt-10 -66.46 -32.68 74.2 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.18 -0.464 . . . . 70.34 110.825 -179.88 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 37.5 t80 -66.33 -45.32 80.64 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.177 -0.465 . . . . 64.33 110.926 -179.952 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 142' ' ' VAL . . . . . 0.94 HG22 HG21 ' A' ' 85' ' ' ILE . 66.8 t -69.53 -39.64 78.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.101 -0.499 . . . . 64.34 111.113 179.962 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 30.6 tt0 -62.28 -57.83 9.96 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.2 -0.455 . . . . 61.25 110.856 -179.964 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 11.6 tpt -56.57 -30.73 63.48 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.256 -0.429 . . . . 72.35 110.882 179.966 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 145' ' ' MET . . . . . 0.486 ' HE1' HG22 ' M' ' 19' ' ' ILE . 5.6 ttm -75.87 -37.22 59.13 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.219 -0.446 . . . . 64.44 110.935 179.934 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 1.9 m . . . . . 0 C--N 1.33 -0.28 0 CA-C-N 116.16 -0.473 . . . . 55.24 111.158 -179.927 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' M' M ' 15' ' ' LYS . . . . . 0.415 ' HB2' ' HE1' ' A' ' 109' ' ' MET . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.119 0 CA-C-O 120.763 0.316 . . . . 73.41 110.914 . . . . . . . . . 2 2 . 1 . 018 nuclear build core ' M' M ' 16' ' ' TRP . . . . . 0.509 ' CZ2' ' HB2' ' A' ' 128' ' ' ALA . 6.1 m95 -58.1 -37.16 73.99 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.246 -0.434 . . . . 72.24 110.957 179.917 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' M' M ' 17' ' ' GLU . . . . . . . . . . . . . 11.9 tt0 -60.27 -22.06 62.64 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.24 -0.436 . . . . 74.05 110.911 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' M' M ' 18' ' ' LYS . . . . . . . . . . . . . 19.9 ttpp -65.31 -24.79 67.37 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.137 -0.483 . . . . 75.31 110.896 179.941 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' M' M ' 19' ' ' ILE . . . . . 0.486 HG22 ' HE1' ' A' ' 145' ' ' MET . 33.1 mt -97.09 -23.14 4.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.219 -0.446 . . . . 65.43 111.088 179.927 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' M' M ' 20' ' ' ARG . . . . . . . . . . . . . 37.1 ttp85 . . . . . 0 C--N 1.329 -0.311 0 CA-C-N 116.17 -0.468 . . . . 55.24 110.87 179.986 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' M' M ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.169 0 CA-C-O 120.806 0.336 . . . . 74.25 110.878 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' M' M ' 31' ' ' LEU . . . . . . . . . . . . . 11.8 tp -157.59 -49.89 0.07 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.259 -0.428 . . . . 65.22 110.928 179.902 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' M' M ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.43 -35.89 41.41 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.21 -0.45 . . . . 73.13 110.882 179.826 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' M' M ' 33' ' ' HIS . . . . . . . . . . . . . 13.0 t-80 -50.86 -38.72 50.96 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.189 -0.46 . . . . 44.22 110.853 179.908 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' M' M ' 34' ' ' ILE . . . . . . . . . . . . . 49.5 mm -50.03 -38.7 14.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.243 -0.435 . . . . 74.45 111.153 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' M' M ' 35' ' ' VAL . . . . . . . . . . . . . 40.9 t -50.17 -40.17 17.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.182 -0.463 . . . . 74.03 111.142 179.854 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' M' M ' 36' ' ' TRP . . . . . . . . . . . . . 20.9 m0 -59.66 -36.57 76.68 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.19 -0.459 . . . . 61.42 110.893 179.977 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' M' M ' 37' ' ' ALA . . . . . 0.963 ' HB3' HD13 ' A' ' 39' ' ' LEU . . . -63.62 -18.83 64.33 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.239 -0.437 . . . . 74.2 111.076 179.901 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' M' M ' 38' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -73.67 -17.94 61.08 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.208 -0.451 . . . . 74.31 110.858 -179.754 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' M' M ' 39' ' ' ARG . . . . . . . . . . . . . 14.2 ttt180 -55.0 -26.58 37.92 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.1 -0.5 . . . . 64.23 110.888 -179.976 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' M' M ' 40' ' ' GLU . . . . . . . . . . . . . 3.5 pt-20 -84.58 -32.21 23.91 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.166 -0.47 . . . . 74.35 110.868 -179.896 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' M' M ' 41' ' ' LEU . . . . . 0.636 HD21 ' OG ' ' A' ' 38' ' ' SER . 11.2 mt . . . . . 0 C--N 1.328 -0.367 0 CA-C-N 116.146 -0.479 . . . . 73.15 110.929 -179.985 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 47.8 tt0 . . . . . 0 C--O 1.231 0.106 0 CA-C-O 120.77 0.319 . . . . 72.31 110.922 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 52.8 mt -72.9 -40.93 60.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.183 -0.462 . . . . 63.2 111.145 179.983 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.41 -28.15 69.58 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.124 -0.489 . . . . 73.15 111.144 179.756 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 19.5 mm-40 -74.93 -52.14 11.97 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.214 -0.448 . . . . 61.13 110.88 -179.909 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 26.3 m-85 -66.89 -45.99 76.28 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.156 -0.475 . . . . 73.12 110.88 -179.919 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -52.92 -46.17 67.95 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.143 -0.48 . . . . 72.5 110.931 179.948 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -54.93 -30.84 59.54 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.188 -0.46 . . . . 73.23 110.868 -179.997 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -69.52 -45.29 69.18 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.172 -0.467 . . . . 64.05 111.08 179.933 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 85.5 t80 -54.75 -54.26 44.31 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.191 -0.459 . . . . 75.33 110.903 -179.906 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 10.6 t -61.58 -26.38 67.93 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.15 -0.477 . . . . 61.12 110.902 -179.806 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 2.9 tt -65.31 -40.03 93.23 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.104 -0.498 . . . . 72.44 110.911 -179.994 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.664 ' CD1' HG11 ' A' ' 35' ' ' VAL . 36.1 m-85 -77.6 -34.62 53.39 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.147 -0.478 . . . . 54.11 110.881 179.965 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 15.9 t0 -67.21 98.57 0.62 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.134 -0.484 . . . . 61.24 110.892 179.998 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 23.3 mmtp -72.06 -56.46 5.58 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.226 -0.443 . . . . 70.13 110.893 -179.994 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 17.1 p-10 -71.01 -10.24 59.4 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.19 -0.459 . . . . 72.01 110.877 179.859 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 51.54 71.21 0.69 Allowed Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.751 -0.738 . . . . 75.23 112.438 -179.997 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 22.7 p-10 -114.52 -15.75 11.99 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.874 0.368 . . . . 72.42 110.884 179.995 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 101.21 12.37 36.48 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.718 -0.753 . . . . 50.12 112.484 -179.926 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 1.9 p -154.66 144.47 21.62 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.743 0.306 . . . . 73.32 111.133 -179.853 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 22.2 mt -102.93 114.46 42.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.237 -0.438 . . . . 71.22 111.109 179.934 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.782 HG22 HG21 ' A' ' 62' ' ' THR . 19.2 p -102.06 174.91 5.72 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.146 -0.479 . . . . 74.33 111.172 179.945 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.473 HG22 HD12 ' A' ' 52' ' ' ILE . 69.9 p -61.0 -29.97 70.01 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.198 -0.455 . . . . 63.13 111.149 -179.979 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 32.3 mtmt -79.89 -50.12 10.93 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.258 -0.428 . . . . 71.24 110.841 179.96 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.415 ' OE1' HG23 ' A' ' 28' ' ' THR . 50.8 mt-10 -63.34 -35.91 81.95 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.234 -0.439 . . . . 73.32 110.919 179.981 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.0 tt -74.25 -52.2 13.06 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.121 -0.49 . . . . 70.44 110.927 179.983 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -52.17 -29.2 28.48 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.782 -0.723 . . . . 52.22 112.477 179.928 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 95.5 m -66.07 -58.91 4.42 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.853 0.359 . . . . 64.3 111.125 -179.828 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.664 HG11 ' CD1' ' A' ' 19' ' ' PHE . 94.2 t -54.39 -45.95 69.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.216 -0.447 . . . . 72.14 111.141 179.902 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 1.9 mmm -52.18 -38.24 57.2 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.198 -0.455 . . . . 73.21 110.858 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 3.8 tmt_? -55.55 -52.74 62.72 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.214 -0.448 . . . . 63.13 110.921 -179.95 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' SER . . . . . 0.673 ' OG ' HD21 ' M' ' 41' ' ' LEU . 5.9 t -59.89 -29.74 68.53 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.184 -0.462 . . . . 73.12 110.889 -179.813 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 1.03 HD13 ' HB3' ' M' ' 37' ' ' ALA . 48.2 mt -80.26 -21.46 42.72 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.099 -0.5 . . . . 74.04 110.93 179.957 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 101.46 31.02 5.68 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.754 -0.736 . . . . 53.24 112.448 179.868 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -127.4 113.45 16.24 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.814 0.34 . . . . 73.53 110.917 -179.924 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 32.3 t-20 -109.87 81.22 1.95 Allowed Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.628 0.728 . . . . 73.33 110.857 -179.96 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.72 167.95 22.92 Favored 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.673 2.249 . . . . 73.51 112.395 179.887 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 20.2 p -98.44 157.46 16.2 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.239 -0.437 . . . . 63.33 111.153 -179.97 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -52.02 -45.19 64.49 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.245 -0.434 . . . . 74.54 110.834 -179.952 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.555 ' HB3' ' HB2' ' A' ' 139' ' ' GLU . . . -71.07 -31.65 68.1 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.209 -0.45 . . . . 73.31 111.124 179.914 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -66.67 -49.19 66.94 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.206 -0.452 . . . . 60.31 110.871 -179.914 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 16.3 mt -55.17 -50.65 68.77 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.142 -0.481 . . . . 73.43 110.936 -179.96 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 -60.19 -28.6 68.1 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.155 -0.475 . . . . 43.11 110.947 179.919 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 45.4 t0 -74.18 -49.8 21.97 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.19 -0.459 . . . . 71.34 110.87 -179.99 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' MET . . . . . 0.543 ' CE ' HD13 ' M' ' 31' ' ' LEU . 15.6 ptm -66.95 -41.65 86.58 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.153 -0.476 . . . . 62.22 110.926 179.974 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.473 HD12 HG22 ' A' ' 29' ' ' THR . 96.9 mt -66.76 -37.95 80.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.204 -0.453 . . . . 74.3 111.15 179.931 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 37.9 m-20 -63.2 -24.9 68.09 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.143 -0.48 . . . . 60.34 110.842 179.982 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 15.9 mm-40 -73.09 -41.2 64.33 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.194 -0.457 . . . . 74.21 110.886 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 32.6 m -86.37 -17.5 9.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.134 -0.485 . . . . 73.34 111.138 179.991 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 39.0 t0 -66.84 94.1 0.3 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.146 -0.479 . . . . 74.55 110.825 179.978 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.3 -29.79 20.11 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.183 -0.462 . . . . 63.43 111.037 179.974 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -92.86 -0.19 57.29 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.256 -0.429 . . . . 70.15 110.874 -179.976 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 52.18 60.11 8.07 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.739 -0.743 . . . . 51.31 112.498 -179.922 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 44.8 p-10 -114.43 -15.88 12.01 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.896 0.379 . . . . 64.41 110.902 -179.911 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 96.22 8.34 57.77 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.724 -0.75 . . . . 72.21 112.436 179.947 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' THR . . . . . 0.782 HG21 HG22 ' A' ' 28' ' ' THR . 71.9 p -150.61 175.11 12.24 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.772 0.32 . . . . 61.42 111.131 -179.853 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 19.3 mt -101.67 115.6 43.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.204 -0.453 . . . . 65.13 111.146 179.874 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 27.4 m-20 -78.46 -172.88 3.08 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.155 -0.475 . . . . 61.31 110.905 179.837 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.529 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 2.5 t80 -64.83 -58.37 13.28 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 121.632 0.73 . . . . 74.23 110.847 -179.838 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 66' ' ' PRO . . . . . 0.529 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 54.1 Cg_endo -69.75 -31.01 21.41 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.674 2.249 . . . . 74.31 112.34 -179.997 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 19.9 mt-10 -57.45 -41.86 81.37 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.2 -0.455 . . . . 73.52 110.863 -179.942 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 10.6 t80 -73.93 -36.07 64.65 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.174 -0.467 . . . . 73.23 110.908 -179.921 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 16.8 tp -66.68 -53.92 28.67 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.146 -0.479 . . . . 74.5 110.878 -179.986 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 15.3 t -56.21 -31.23 63.3 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.2 -0.455 . . . . 74.31 111.117 179.962 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 41.4 ttp -60.05 -50.37 73.99 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.237 -0.438 . . . . 73.44 110.848 179.95 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' MET . . . . . 0.45 ' HE2' HG21 ' M' ' 35' ' ' VAL . 1.0 OUTLIER -52.83 -44.67 66.88 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.257 -0.429 . . . . 73.25 110.901 179.93 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.289 0 CA-C-N 116.189 -0.46 . . . . 63.53 111.104 179.937 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.817 HG21 HG22 ' A' ' 142' ' ' VAL . 32.4 mt . . . . . 0 C--O 1.231 0.109 0 CA-C-O 120.838 0.351 . . . . 62.13 111.108 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 2.3 tmt_? -56.26 -53.63 54.95 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.187 -0.461 . . . . 64.11 110.856 -179.987 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.729 ' O ' HG23 ' A' ' 91' ' ' VAL . 11.7 tm-20 -56.77 -56.08 26.06 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.173 -0.467 . . . . 72.42 110.885 -179.948 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -53.33 -50.93 63.97 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.204 -0.453 . . . . 43.13 111.113 179.921 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 5.1 t80 -61.03 -35.15 76.14 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.237 -0.438 . . . . 73.24 110.832 -179.888 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 14.8 ttt-85 -72.42 -27.48 62.36 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.136 -0.484 . . . . 64.21 110.911 -179.928 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 91' ' ' VAL . . . . . 0.729 HG23 ' O ' ' A' ' 87' ' ' GLU . 86.2 t -75.12 -28.02 20.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.176 -0.465 . . . . 75.12 111.14 179.98 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 8.7 m-85 -95.72 -30.34 13.79 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.152 -0.476 . . . . 74.3 110.872 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 43.7 t0 -76.68 89.41 3.36 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.168 -0.469 . . . . 72.32 110.883 179.995 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 34.0 mmtt -78.02 -48.77 15.41 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.185 -0.461 . . . . 64.11 110.929 179.982 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 9.5 p30 -72.58 -9.09 58.16 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.237 -0.438 . . . . 74.11 110.841 179.903 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 60.04 28.83 66.95 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.7 -0.762 . . . . 65.24 112.504 -179.933 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 43.8 p-10 -81.89 -16.1 51.77 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.89 0.376 . . . . 72.01 110.915 -179.885 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 82.36 18.72 65.93 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.746 -0.74 . . . . 43.12 112.5 179.966 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 19.0 m-85 -137.56 136.63 37.78 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.849 0.357 . . . . 54.03 110.917 -179.76 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 79.9 mt -106.05 124.94 61.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.141 -0.482 . . . . 72.13 111.112 179.939 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 40.2 p -116.45 176.22 5.21 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.175 -0.466 . . . . 72.31 110.883 -179.945 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -60.28 -38.88 84.95 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.12 -0.491 . . . . 65.55 111.13 179.881 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -62.42 -39.6 93.83 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.211 -0.449 . . . . 63.11 111.074 179.933 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 104' ' ' GLU . . . . . 0.725 ' O ' HG23 ' A' ' 108' ' ' VAL . 54.6 mt-10 -73.46 -51.56 16.76 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.207 -0.451 . . . . 73.44 110.874 -179.926 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.424 HD11 HD13 ' M' ' 19' ' ' ILE . 17.2 tp -56.2 -44.52 79.54 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.195 -0.457 . . . . 73.04 110.918 -179.955 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 27.5 ttt180 -52.59 -49.2 65.48 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.211 -0.45 . . . . 72.45 110.832 179.958 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 81.0 t60 -65.57 -34.81 79.11 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.18 -0.463 . . . . 74.32 110.86 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.725 HG23 ' O ' ' A' ' 104' ' ' GLU . 91.2 t -59.18 -52.28 62.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.229 -0.442 . . . . 55.42 111.145 179.974 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 2.2 tpt -56.16 -36.35 68.21 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.19 -0.459 . . . . 64.24 110.875 179.893 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -53.56 -35.26 60.58 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.261 -0.427 . . . . 71.04 111.129 -179.917 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 5.2 t30 -74.53 -26.57 60.06 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.197 -0.456 . . . . 74.21 110.897 -179.985 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 15.4 mt -77.73 -25.37 49.25 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.141 -0.481 . . . . 74.44 110.894 179.976 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 101.07 32.97 5.11 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.716 -0.754 . . . . 43.05 112.498 179.877 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 21.2 mm-40 -129.43 110.11 11.62 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.931 0.396 . . . . 72.34 110.85 -179.852 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 115' ' ' LYS . . . . . 0.426 ' O ' HD23 ' A' ' 116' ' ' LEU . 20.8 pttp -72.59 135.83 45.63 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.104 -0.498 . . . . 52.0 110.901 179.961 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.558 HD21 ' HD3' ' M' ' 15' ' ' LYS . 75.0 mt -138.23 157.57 46.02 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.259 -0.428 . . . . 62.53 110.894 179.914 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 69.6 p -107.74 163.26 13.25 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.184 -0.462 . . . . 72.54 111.146 179.959 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 14.2 m-20 -52.12 -40.87 61.96 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.219 -0.446 . . . . 53.41 110.844 179.913 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 59.7 tt0 -72.98 -33.52 65.88 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.185 -0.461 . . . . 71.43 110.898 -179.881 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 120' ' ' GLU . . . . . 0.497 ' HG2' HD22 ' A' ' 116' ' ' LEU . 6.1 tp10 -66.5 -44.33 82.85 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.109 -0.496 . . . . 72.04 110.904 -179.953 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 91.1 t -57.81 -31.07 39.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.152 -0.476 . . . . 63.54 111.08 -179.994 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 19.0 t0 -59.62 -45.39 92.08 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.235 -0.439 . . . . 74.14 110.859 179.928 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -55.81 -30.3 61.15 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.182 -0.463 . . . . 73.02 110.888 -179.909 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 4.3 mtt -76.01 -59.41 2.77 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.111 -0.495 . . . . 73.12 110.929 179.956 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 36.1 mm -53.99 -35.5 28.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.234 -0.439 . . . . 75.4 111.138 179.973 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 52.8 ttt85 -63.01 -31.79 73.01 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.178 -0.464 . . . . 75.25 110.875 179.944 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 31.7 tp10 -75.14 -52.44 10.99 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.164 -0.471 . . . . 72.32 110.895 -179.912 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.511 ' HB3' HG22 ' A' ' 136' ' ' VAL . . . -64.86 -34.47 78.46 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.149 -0.478 . . . . 65.42 111.119 179.889 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 48.7 t0 -68.46 86.93 0.3 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.219 -0.446 . . . . 73.42 110.861 -179.973 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 130' ' ' ILE . . . . . 0.764 HD12 ' HG2' ' A' ' 140' ' ' GLU . 7.8 mt -79.97 -46.88 22.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.184 -0.462 . . . . 75.45 111.108 -179.984 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 21.1 p30 -72.47 -8.84 57.18 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.199 -0.455 . . . . 74.51 110.908 179.836 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 63.15 44.47 97.12 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.767 -0.73 . . . . 72.25 112.476 -179.97 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 35.5 p-10 -90.67 -15.95 29.45 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.86 0.362 . . . . 60.33 110.883 -179.948 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 102.79 3.02 49.54 Favored Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 120.75 -0.738 . . . . 73.42 112.492 -179.96 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 5.3 tt0 -149.27 172.3 15.09 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.824 0.345 . . . . 75.12 110.932 -179.925 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 136' ' ' VAL . . . . . 0.511 HG22 ' HB3' ' A' ' 128' ' ' ALA . 60.0 t -112.03 109.1 27.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.236 -0.438 . . . . 54.33 111.133 179.991 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 17.2 p30 -90.52 173.04 8.29 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.205 -0.452 . . . . 74.11 110.916 179.985 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 138' ' ' TYR . . . . . 0.666 ' O ' HG23 ' A' ' 142' ' ' VAL . 55.4 t80 -58.75 -47.44 84.64 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.213 -0.449 . . . . 72.14 110.94 -179.926 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 139' ' ' GLU . . . . . 0.555 ' HB2' ' HB3' ' A' ' 46' ' ' ALA . 78.4 tt0 -51.89 -39.69 59.44 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.095 -0.502 . . . . 72.24 110.929 179.986 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 140' ' ' GLU . . . . . 0.764 ' HG2' HD12 ' A' ' 130' ' ' ILE . 89.6 mt-10 -78.09 -38.31 44.45 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.135 -0.484 . . . . 71.04 110.876 -179.938 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 51.7 t80 -63.19 -35.55 80.69 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.195 -0.457 . . . . 74.2 110.841 -179.93 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 142' ' ' VAL . . . . . 0.817 HG22 HG21 ' A' ' 85' ' ' ILE . 99.5 t -64.43 -44.43 97.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.149 -0.478 . . . . 75.15 111.138 -179.99 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 14.5 tt0 -74.03 -30.49 62.46 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.138 -0.483 . . . . 73.33 110.901 -179.993 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 6.9 tpt -73.1 -30.68 63.84 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.177 -0.465 . . . . 52.31 110.88 -179.999 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 145' ' ' MET . . . . . 0.518 ' HE1' HG22 ' M' ' 19' ' ' ILE . 0.0 OUTLIER -82.48 -26.22 32.8 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.241 -0.436 . . . . 73.34 110.865 179.954 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 87.3 m . . . . . 0 C--N 1.329 -0.285 0 CA-C-N 116.217 -0.447 . . . . 73.44 111.172 -179.927 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' M' M ' 15' ' ' LYS . . . . . 0.558 ' HD3' HD21 ' A' ' 116' ' ' LEU . 12.8 mttm . . . . . 0 C--O 1.231 0.112 0 CA-C-O 120.792 0.329 . . . . 65.43 110.87 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' M' M ' 16' ' ' TRP . . . . . 0.713 ' CE3' HD12 ' M' ' 19' ' ' ILE . 7.8 m95 -51.79 -46.63 64.26 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.21 -0.45 . . . . 71.41 110.906 179.957 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' M' M ' 17' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -56.17 -28.44 58.1 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.262 -0.426 . . . . 71.32 110.882 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' M' M ' 18' ' ' LYS . . . . . . . . . . . . . 6.2 ttpm? -76.7 -26.01 54.24 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.15 -0.477 . . . . 62.02 110.883 179.98 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' M' M ' 19' ' ' ILE . . . . . 0.713 HD12 ' CE3' ' M' ' 16' ' ' TRP . 76.6 mt -79.35 -22.66 12.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.259 -0.428 . . . . 71.11 111.126 179.871 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' M' M ' 20' ' ' ARG . . . . . . . . . . . . . 47.7 ttp85 . . . . . 0 C--N 1.33 -0.281 0 CA-C-N 116.188 -0.46 . . . . 74.21 110.874 179.993 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' M' M ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.134 0 CA-C-O 120.788 0.327 . . . . 64.12 110.898 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' M' M ' 31' ' ' LEU . . . . . 0.543 HD13 ' CE ' ' A' ' 51' ' ' MET . 19.6 tp -130.08 -44.33 1.16 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.24 -0.437 . . . . 62.35 110.905 179.899 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' M' M ' 32' ' ' LYS . . . . . 0.404 ' O ' HG23 ' M' ' 35' ' ' VAL . 3.2 tttt -49.15 -43.71 42.02 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.201 -0.454 . . . . 73.04 110.925 179.849 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' M' M ' 33' ' ' HIS . . . . . . . . . . . . . 11.9 t60 -50.92 -39.01 53.63 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.227 -0.442 . . . . 72.13 110.841 179.853 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' M' M ' 34' ' ' ILE . . . . . . . . . . . . . 50.3 mm -51.26 -38.18 19.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.24 -0.436 . . . . 63.4 111.151 179.994 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' M' M ' 35' ' ' VAL . . . . . 0.45 HG21 ' HE2' ' A' ' 72' ' ' MET . 44.1 t -48.88 -38.84 10.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.2 -0.454 . . . . 71.53 111.18 179.819 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' M' M ' 36' ' ' TRP . . . . . . . . . . . . . 20.1 m0 -58.46 -40.31 82.32 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.154 -0.475 . . . . 65.42 110.871 179.975 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' M' M ' 37' ' ' ALA . . . . . 1.03 ' HB3' HD13 ' A' ' 39' ' ' LEU . . . -63.89 -18.85 64.6 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.283 -0.417 . . . . 72.11 111.089 179.891 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' M' M ' 38' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -81.39 -17.79 47.76 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.215 -0.448 . . . . 75.03 110.882 -179.763 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' M' M ' 39' ' ' ARG . . . . . . . . . . . . . 20.3 ttt-85 -54.99 -26.63 38.12 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.129 -0.487 . . . . 74.1 110.906 -179.975 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' M' M ' 40' ' ' GLU . . . . . . . . . . . . . 71.9 mt-10 -87.35 -45.69 10.34 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.166 -0.47 . . . . 74.12 110.892 -179.948 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' M' M ' 41' ' ' LEU . . . . . 0.673 HD21 ' OG ' ' A' ' 38' ' ' SER . 10.7 mt . . . . . 0 C--N 1.329 -0.313 0 CA-C-N 116.153 -0.476 . . . . 70.23 110.92 179.994 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 9.1 tp-100 . . . . . 0 C--O 1.231 0.089 0 CA-C-O 120.808 0.337 . . . . 74.33 110.92 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 59.5 mt -70.84 -45.48 73.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.161 -0.472 . . . . 72.03 111.125 179.969 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -54.73 -29.01 52.43 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.168 -0.469 . . . . 72.12 111.089 179.845 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 34.7 mm-40 -74.58 -52.23 12.37 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.212 -0.449 . . . . 71.34 110.915 -179.923 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 24.5 m-85 -63.05 -46.01 89.52 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.142 -0.481 . . . . 62.42 110.871 -179.924 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 2.5 tmtm? -54.69 -34.8 62.85 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.154 -0.475 . . . . 74.14 110.889 179.97 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 49.1 tt0 -64.91 -33.32 75.75 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.2 -0.455 . . . . 61.14 110.852 -179.994 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -66.8 -41.35 87.75 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.177 -0.465 . . . . 71.12 111.106 179.945 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 88.8 t80 -61.5 -54.28 45.29 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.194 -0.457 . . . . 72.23 110.877 -179.929 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 22.6 t -57.19 -26.45 60.66 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.15 -0.477 . . . . 51.22 110.858 -179.785 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.492 HD23 ' HB3' ' M' ' 38' ' ' SER . 15.3 tp -66.85 -44.32 81.35 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.136 -0.484 . . . . 75.32 110.921 -179.955 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.693 ' CD1' HG11 ' A' ' 35' ' ' VAL . 36.8 m-85 -74.61 -30.79 61.79 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.166 -0.47 . . . . 73.2 110.876 179.924 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 17.9 t0 -72.73 98.69 2.44 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.114 -0.494 . . . . 63.43 110.878 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 19.3 mtpp -68.97 -53.3 21.41 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.147 -0.479 . . . . 65.21 110.93 179.961 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 20.8 p-10 -74.18 -10.47 59.64 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.184 -0.462 . . . . 71.5 110.856 179.876 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 50.94 43.6 49.19 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.719 -0.753 . . . . 72.43 112.504 -179.918 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 35.7 p-10 -88.04 -15.61 35.88 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.824 0.345 . . . . 54.51 110.856 -179.966 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 105.38 -11.58 47.38 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.727 -0.749 . . . . 63.13 112.511 -179.922 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 9.9 p -132.99 130.7 39.84 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.764 0.316 . . . . 72.31 111.13 -179.891 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 22.2 mt -86.6 122.7 39.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.203 -0.453 . . . . 72.41 111.168 179.898 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 81.6 p -98.28 176.94 5.53 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.199 -0.455 . . . . 73.3 111.14 179.98 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.708 HG22 HD12 ' A' ' 52' ' ' ILE . 62.4 p -65.22 -45.05 86.27 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.222 -0.445 . . . . 71.12 111.147 -179.98 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 21.2 mtmm -64.22 -42.83 96.4 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.219 -0.446 . . . . 72.22 110.858 179.91 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -67.48 -32.7 73.72 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.248 -0.433 . . . . 72.52 110.844 -179.992 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.582 HD12 ' CD2' ' A' ' 48' ' ' LEU . 1.0 OUTLIER -68.35 -44.73 74.62 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.191 -0.459 . . . . 72.53 110.934 -179.95 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -71.76 -27.87 70.06 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.722 -0.752 . . . . 52.01 112.482 179.875 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 94.5 m -63.95 -54.22 37.96 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.808 0.337 . . . . 55.21 111.211 -179.889 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.693 HG11 ' CD1' ' A' ' 19' ' ' PHE . 47.2 t -58.18 -53.29 47.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.173 -0.467 . . . . 43.42 111.138 179.882 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 2.2 mtt -52.01 -36.61 50.52 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.181 -0.463 . . . . 75.42 110.856 179.938 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 34.5 ttt-85 -54.1 -46.7 72.15 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.204 -0.453 . . . . 74.41 110.859 -179.917 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' SER . . . . . 0.632 ' OG ' HD21 ' M' ' 41' ' ' LEU . 3.1 t -68.81 -26.2 65.06 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.201 -0.454 . . . . 74.32 110.892 -179.805 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.986 HD13 ' HB3' ' M' ' 37' ' ' ALA . 39.0 mt -82.73 -18.16 41.77 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.114 -0.494 . . . . 73.01 110.918 179.974 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 101.55 28.61 6.62 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.76 -0.733 . . . . 61.13 112.496 179.924 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 8.1 mm100 -116.7 123.26 46.79 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.801 0.334 . . . . 71.12 110.923 -179.89 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 32.5 t-20 -109.91 76.76 1.0 Allowed Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 121.638 0.732 . . . . 63.2 110.876 -179.929 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.7 168.06 22.58 Favored 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.672 2.248 . . . . 65.3 112.314 179.939 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 19.5 p -112.77 154.09 26.76 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.177 -0.465 . . . . 71.12 111.118 -179.951 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 12.3 tp10 -51.96 -38.81 57.88 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.23 -0.441 . . . . 63.2 110.831 -179.991 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.34 -31.5 64.01 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.167 -0.47 . . . . 74.31 111.05 179.974 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 21.4 tt0 -72.94 -52.7 13.57 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.246 -0.434 . . . . 73.22 110.893 -179.924 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.582 ' CD2' HD12 ' A' ' 32' ' ' LEU . 34.6 mt -56.07 -49.14 74.61 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.145 -0.48 . . . . 74.44 110.893 -179.942 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 12.8 tp60 -56.86 -29.01 62.51 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.207 -0.451 . . . . 72.5 110.923 179.909 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -75.5 -49.66 18.08 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.168 -0.469 . . . . 75.23 110.891 179.966 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 32.6 mtp -60.61 -54.84 40.54 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.211 -0.45 . . . . 63.35 110.895 179.956 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.708 HD12 HG22 ' A' ' 29' ' ' THR . 65.9 mt -53.18 -42.83 47.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.264 -0.425 . . . . 65.11 111.123 179.934 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 76.0 m-20 -71.21 -27.09 63.24 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.204 -0.453 . . . . 61.33 110.865 179.974 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 10.8 tt0 -67.89 -28.95 67.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.195 -0.457 . . . . 73.32 110.893 179.994 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.444 ' CG2' HD12 ' A' ' 63' ' ' ILE . 3.4 m -112.03 16.92 7.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.155 -0.475 . . . . 62.22 111.133 179.951 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 28.8 t0 -88.89 99.55 12.49 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.198 -0.456 . . . . 73.44 110.854 179.908 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.3 -37.72 15.76 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.148 -0.478 . . . . 73.25 111.082 179.942 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -88.66 -0.32 57.17 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.222 -0.445 . . . . 62.4 110.866 179.981 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 51.37 57.89 10.93 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.746 -0.74 . . . . 43.32 112.466 -179.963 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 48.8 p-10 -114.56 -15.73 11.97 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.884 0.373 . . . . 73.15 110.894 -179.896 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 89.84 19.22 48.48 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.777 -0.725 . . . . 53.51 112.546 179.985 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 44.3 p -148.34 168.28 23.02 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.764 0.316 . . . . 73.2 111.144 -179.885 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.489 HD11 ' HA ' ' A' ' 52' ' ' ILE . 13.3 mm -100.93 109.48 25.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.214 -0.448 . . . . 74.14 111.15 179.894 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -76.2 -173.49 2.43 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.193 -0.458 . . . . 73.53 110.848 179.902 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.524 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 2.5 t80 -64.57 -58.51 13.27 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-O 121.651 0.738 . . . . 74.33 110.861 -179.895 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 66' ' ' PRO . . . . . 0.524 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 54.5 Cg_endo -69.69 -30.34 22.77 Favored 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 122.699 2.266 . . . . 51.54 112.38 179.981 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 18.1 mt-10 -57.17 -40.78 77.99 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.221 -0.445 . . . . 74.25 110.847 -179.957 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 12.5 t80 -74.11 -36.1 64.2 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.143 -0.48 . . . . 72.12 110.898 -179.918 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 29.0 tp -67.28 -53.74 27.14 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.137 -0.483 . . . . 75.12 110.935 -179.942 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 12.6 t -53.13 -27.56 21.43 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.173 -0.467 . . . . 73.31 111.101 179.941 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 56.1 ttp -67.51 -42.72 82.35 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.24 -0.436 . . . . 74.31 110.891 179.919 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 2.7 mtt -79.82 -31.71 40.62 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.214 -0.448 . . . . 71.03 110.863 179.998 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.266 0 CA-C-N 116.23 -0.441 . . . . 61.13 111.103 179.877 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.743 HD13 HG13 ' A' ' 142' ' ' VAL . 58.2 mt . . . . . 0 C--O 1.231 0.109 0 CA-C-O 120.823 0.344 . . . . 73.23 111.135 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 13.5 ttt85 -61.7 -28.21 69.25 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.157 -0.474 . . . . 71.32 110.887 179.982 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.727 ' O ' HG23 ' A' ' 91' ' ' VAL . 17.5 tt0 -67.36 -58.01 5.58 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.199 -0.455 . . . . 75.03 110.886 -179.941 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 88' ' ' ALA . . . . . 0.449 ' HB1' ' CE2' ' A' ' 92' ' ' PHE . . . -59.52 -47.38 85.76 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.196 -0.457 . . . . 54.31 111.086 179.927 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -52.03 -43.89 63.95 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.181 -0.463 . . . . 74.53 110.866 -179.878 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 60.8 ttt180 -69.53 -32.19 70.87 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.135 -0.484 . . . . 73.24 110.899 -179.917 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 91' ' ' VAL . . . . . 0.727 HG23 ' O ' ' A' ' 87' ' ' GLU . 90.8 t -68.5 -27.76 37.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.172 -0.467 . . . . 64.31 111.13 179.957 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.449 ' CE2' ' HB1' ' A' ' 88' ' ' ALA . 9.1 m-85 -93.68 -33.33 13.69 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.198 -0.455 . . . . 74.52 110.904 179.994 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 25.8 t0 -64.25 96.75 0.16 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.159 -0.473 . . . . 75.21 110.874 179.965 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 7.4 tppt? -78.72 -53.21 7.38 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.16 -0.473 . . . . 73.41 110.914 -179.992 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 56.4 p-10 -72.85 -9.07 58.26 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.249 -0.432 . . . . 75.51 110.891 179.848 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 59.63 26.68 62.73 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.772 -0.727 . . . . 63.45 112.448 -179.981 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 39.3 p-10 -81.8 -16.14 51.91 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.869 0.366 . . . . 63.42 110.895 -179.864 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 88.48 18.72 54.53 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.727 -0.749 . . . . 74.3 112.441 179.946 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 19.0 m-85 -140.52 150.19 43.41 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.889 0.376 . . . . 74.31 110.944 -179.823 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 62.3 mt -120.98 133.48 67.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.111 -0.495 . . . . 53.42 111.157 179.907 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 97.8 p -114.44 177.74 4.53 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.174 -0.466 . . . . 72.54 110.897 -179.896 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 102' ' ' ALA . . . . . 0.679 ' O ' HG11 ' A' ' 121' ' ' VAL . . . -60.66 -34.54 74.45 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.201 -0.454 . . . . 72.1 111.081 179.927 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -71.9 -49.33 38.78 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.279 -0.419 . . . . 70.11 111.093 179.966 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 17.4 mt-10 -63.01 -46.52 87.27 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.202 -0.454 . . . . 51.41 110.893 -179.922 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 26.4 tp -52.98 -42.7 65.79 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.137 -0.483 . . . . 73.23 110.887 -179.977 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 106' ' ' ARG . . . . . 0.705 ' HB2' HG21 ' A' ' 121' ' ' VAL . 5.9 ttt-85 -62.13 -34.95 77.33 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.219 -0.446 . . . . 71.14 110.873 179.952 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 16.5 t60 -58.52 -34.9 71.48 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.175 -0.466 . . . . 74.44 110.871 179.998 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.591 ' O ' HD12 ' A' ' 112' ' ' LEU . 58.0 t -70.99 -39.17 74.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.242 -0.435 . . . . 64.22 111.084 -179.99 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 109' ' ' MET . . . . . 0.619 ' CB ' HD12 ' A' ' 116' ' ' LEU . 5.1 mmt -76.43 -26.67 55.73 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.229 -0.441 . . . . 75.54 110.885 179.917 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 40.4 m -71.66 -56.04 6.57 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.221 -0.445 . . . . 74.24 111.164 -179.952 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -56.09 -31.16 62.99 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.219 -0.446 . . . . 72.12 110.921 179.956 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.591 HD12 ' O ' ' A' ' 108' ' ' VAL . 3.2 mt -71.46 -25.86 62.47 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.137 -0.483 . . . . 73.44 110.931 179.982 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 100.95 33.01 5.13 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.777 -0.725 . . . . 62.23 112.508 179.933 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 29.6 tp10 -110.08 110.18 20.98 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.932 0.396 . . . . 75.23 110.875 -179.896 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 30.9 mttm -60.79 102.68 0.2 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.124 -0.489 . . . . 73.2 110.894 179.984 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.619 HD12 ' CB ' ' A' ' 109' ' ' MET . 81.1 mt -138.95 146.76 41.39 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.222 -0.445 . . . . 52.25 110.937 179.893 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 117' ' ' THR . . . . . 0.611 ' O ' HG23 ' A' ' 121' ' ' VAL . 41.8 p -112.62 175.12 5.57 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.185 -0.461 . . . . 71.41 111.131 179.934 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -57.1 -45.05 83.71 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.175 -0.466 . . . . 73.23 110.877 179.882 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 13.6 tp10 -62.55 -33.64 75.33 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.174 -0.466 . . . . 70.21 110.871 -179.898 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 18.5 tt0 -73.84 -31.4 63.18 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.184 -0.462 . . . . 75.21 110.91 -179.942 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.705 HG21 ' HB2' ' A' ' 106' ' ' ARG . 65.0 t -72.5 -30.72 35.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.135 -0.484 . . . . 61.41 111.083 -179.986 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -51.94 -47.24 64.8 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.193 -0.458 . . . . 74.43 110.86 179.928 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 13.0 tp10 -56.79 -29.51 62.75 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.201 -0.454 . . . . 73.11 110.917 -179.917 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 17.2 mtp -73.96 -59.01 2.92 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.129 -0.487 . . . . 72.4 110.898 179.973 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 35.4 mm -53.93 -35.76 28.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.211 -0.45 . . . . 74.52 111.161 179.926 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 63.8 ttt180 -65.13 -31.83 73.22 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.15 -0.477 . . . . 71.22 110.888 179.944 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -72.46 -50.2 27.82 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.158 -0.474 . . . . 73.34 110.871 -179.931 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.614 ' HB3' HG22 ' A' ' 136' ' ' VAL . . . -69.36 -34.01 73.94 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.204 -0.453 . . . . 74.32 111.064 179.961 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 50.3 t0 -68.41 86.6 0.29 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.229 -0.442 . . . . 72.43 110.818 -179.984 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 60.0 mt -79.93 -45.56 22.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.221 -0.445 . . . . 73.2 111.091 179.969 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 22.6 p30 -72.73 -8.79 57.12 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.192 -0.458 . . . . 73.33 110.827 179.928 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 62.77 43.34 99.1 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.717 -0.754 . . . . 50.33 112.512 -179.932 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 32.5 p-10 -88.69 -16.02 33.38 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.902 0.382 . . . . 53.42 110.888 -179.944 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 103.37 2.94 47.67 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.691 -0.766 . . . . 34.03 112.482 -179.936 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 5.1 tt0 -149.25 172.26 15.15 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.799 0.333 . . . . 71.02 110.898 -179.861 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 136' ' ' VAL . . . . . 0.614 HG22 ' HB3' ' A' ' 128' ' ' ALA . 96.1 t -109.89 118.69 57.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.181 -0.463 . . . . 74.52 111.143 179.963 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 44.2 p-10 -102.16 166.85 10.37 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.204 -0.453 . . . . 65.34 110.928 179.989 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 138' ' ' TYR . . . . . 0.704 ' O ' HG23 ' A' ' 142' ' ' VAL . 48.0 t80 -51.9 -45.62 64.26 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.206 -0.452 . . . . 72.34 110.913 -179.893 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 6.1 tm-20 -53.4 -40.61 65.19 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.122 -0.49 . . . . 74.4 110.833 -179.941 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 17.5 mt-10 -78.43 -34.5 47.82 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.154 -0.476 . . . . 74.02 110.906 -179.91 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 41.1 t80 -67.15 -35.41 79.64 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.184 -0.462 . . . . 72.32 110.856 -179.925 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 142' ' ' VAL . . . . . 0.743 HG13 HD13 ' A' ' 85' ' ' ILE . 97.8 t -64.67 -44.04 96.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.179 -0.464 . . . . 54.41 111.105 -179.998 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 143' ' ' GLN . . . . . 0.56 ' HA ' HG22 ' A' ' 146' ' ' THR . 48.6 tt0 -74.23 -23.84 59.23 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.214 -0.448 . . . . 73.23 110.88 -179.954 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 8.7 tpt -74.99 -18.85 60.3 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.169 -0.469 . . . . 71.12 110.911 179.97 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 9.2 ttm -98.23 -30.75 12.44 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.22 -0.445 . . . . 72.42 110.884 179.971 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 146' ' ' THR . . . . . 0.56 HG22 ' HA ' ' A' ' 143' ' ' GLN . 4.7 t . . . . . 0 C--N 1.329 -0.296 0 CA-C-N 116.236 -0.438 . . . . 75.43 111.174 -179.993 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' M' M ' 15' ' ' LYS . . . . . . . . . . . . . 40.5 mttp . . . . . 0 C--O 1.231 0.122 0 CA-C-O 120.754 0.312 . . . . 62.2 110.875 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' M' M ' 16' ' ' TRP . . . . . 0.514 ' CE3' HD12 ' M' ' 19' ' ' ILE . 24.2 m95 -53.77 -34.5 59.21 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.278 -0.419 . . . . 73.14 110.926 179.964 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' M' M ' 17' ' ' GLU . . . . . . . . . . . . . 5.3 tm-20 -58.67 -25.91 63.27 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.229 -0.441 . . . . 73.01 110.884 179.997 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' M' M ' 18' ' ' LYS . . . . . 0.568 ' NZ ' HD13 ' A' ' 112' ' ' LEU . 16.0 ttpp -67.66 -26.85 66.41 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.185 -0.461 . . . . 71.52 110.91 179.951 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' M' M ' 19' ' ' ILE . . . . . 0.514 HD12 ' CE3' ' M' ' 16' ' ' TRP . 28.2 mt -92.61 -22.81 5.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.215 -0.448 . . . . 51.14 111.13 179.879 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' M' M ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.294 0 CA-C-N 116.165 -0.471 . . . . 73.13 110.856 179.983 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' M' M ' 30' ' ' LYS . . . . . . . . . . . . . 2.1 mtpp . . . . . 0 C--O 1.232 0.164 0 CA-C-O 120.755 0.312 . . . . 71.03 110.887 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' M' M ' 31' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -82.89 -21.16 34.34 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.209 -0.45 . . . . 71.24 110.902 179.93 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' M' M ' 32' ' ' LYS . . . . . 0.408 ' O ' HG23 ' M' ' 35' ' ' VAL . 25.1 ttpp -48.04 -48.61 32.99 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.198 -0.455 . . . . 73.21 110.93 179.813 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' M' M ' 33' ' ' HIS . . . . . . . . . . . . . 11.1 t-80 -52.01 -37.5 53.5 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.233 -0.439 . . . . 75.51 110.846 179.87 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' M' M ' 34' ' ' ILE . . . . . 0.413 ' CG2' HD12 ' A' ' 39' ' ' LEU . 36.3 mm -51.66 -37.19 19.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.184 -0.462 . . . . 73.15 111.108 -179.991 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' M' M ' 35' ' ' VAL . . . . . 0.408 HG23 ' O ' ' M' ' 32' ' ' LYS . 46.3 t -49.48 -38.45 12.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.207 -0.451 . . . . 73.13 111.126 179.862 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' M' M ' 36' ' ' TRP . . . . . . . . . . . . . 16.9 m0 -58.6 -39.52 80.63 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.19 -0.459 . . . . 74.1 110.919 179.999 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' M' M ' 37' ' ' ALA . . . . . 0.986 ' HB3' HD13 ' A' ' 39' ' ' LEU . . . -63.44 -18.7 64.02 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.193 -0.458 . . . . 34.22 111.096 179.905 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' M' M ' 38' ' ' SER . . . . . 0.492 ' HB3' HD23 ' A' ' 18' ' ' LEU . 1.1 m -70.62 -18.03 62.87 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.18 -0.464 . . . . 72.22 110.908 -179.798 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' M' M ' 39' ' ' ARG . . . . . . . . . . . . . 8.7 mmm180 -61.48 -25.14 67.05 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.118 -0.492 . . . . 75.04 110.92 -179.963 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' M' M ' 40' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -85.51 -47.97 9.4 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.143 -0.48 . . . . 74.23 110.851 -179.904 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' M' M ' 41' ' ' LEU . . . . . 0.632 HD21 ' OG ' ' A' ' 38' ' ' SER . 12.0 mt . . . . . 0 C--N 1.329 -0.306 0 CA-C-N 116.191 -0.458 . . . . 74.03 110.882 -179.933 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.119 0 CA-C-O 120.876 0.37 . . . . 71.14 111.115 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 57.89 71.52 0.57 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.188 -0.46 . . . . 74.32 110.884 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 15.4 pt20 -165.33 171.63 13.27 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.125 -0.489 . . . . 72.01 110.923 -179.902 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 9.5 mt -118.2 141.6 48.33 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.221 -0.445 . . . . 55.42 110.871 -179.935 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 30.0 p -117.72 174.57 6.09 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.174 -0.466 . . . . 73.14 111.087 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 70.9 tt0 -53.33 -29.24 32.82 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.183 -0.462 . . . . 55.41 110.88 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -68.12 -41.06 82.3 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.199 -0.455 . . . . 72.44 110.85 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 35.4 tp60 -77.92 -37.79 47.0 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.146 -0.479 . . . . 74.3 110.898 -179.932 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 69.3 mt -71.72 -37.44 62.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.209 -0.45 . . . . 74.21 111.133 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -52.18 -32.92 38.4 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.158 -0.474 . . . . 32.53 111.087 179.796 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 -74.82 -52.1 12.28 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.231 -0.441 . . . . 73.51 110.893 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.556 ' CB ' HD13 ' A' ' 69' ' ' LEU . 50.1 m-85 -58.34 -46.0 87.07 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.181 -0.463 . . . . 65.3 110.843 -179.901 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.0 ttpt -54.89 -29.57 56.11 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.124 -0.489 . . . . 74.5 110.929 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -71.18 -30.76 66.82 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.198 -0.456 . . . . 52.22 110.932 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -64.96 -42.61 94.45 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.157 -0.474 . . . . 64.34 111.107 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 48.5 t80 -55.41 -54.21 46.62 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.168 -0.469 . . . . 71.55 110.898 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 36.5 t -51.99 -36.64 50.4 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.112 -0.495 . . . . 64.34 110.871 -179.812 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 17.7 tp -59.73 -41.62 91.32 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.15 -0.477 . . . . 71.41 110.897 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.412 ' CD1' HG11 ' A' ' 35' ' ' VAL . 33.9 m-85 -82.59 -25.87 32.85 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.227 -0.442 . . . . 74.31 110.852 179.982 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 11.1 t0 -86.69 98.53 11.18 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.179 -0.464 . . . . 53.12 110.89 179.962 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 70.4 mmtt -72.57 -56.85 4.71 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.166 -0.47 . . . . 73.55 110.894 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 27.1 p-10 -72.84 -10.09 59.4 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.206 -0.452 . . . . 63.14 110.835 179.922 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 52.05 49.08 50.74 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.759 -0.734 . . . . 73.5 112.465 -179.935 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 31.1 p-10 -88.53 -15.62 34.76 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.855 0.359 . . . . 55.33 110.871 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 105.31 -11.68 47.69 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.748 -0.739 . . . . 73.4 112.521 -179.912 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 49.0 p -135.21 130.69 35.66 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.75 0.31 . . . . 64.53 111.146 -179.879 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 24.7 mt -88.14 126.44 41.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.206 -0.452 . . . . 62.0 111.109 179.908 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.681 HG22 ' CG2' ' A' ' 62' ' ' THR . 60.4 p -110.33 176.2 5.14 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.187 -0.46 . . . . 50.32 111.143 179.962 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 21.7 p -64.12 -32.88 74.61 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.242 -0.435 . . . . 71.23 111.128 -179.964 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 43.5 mtpt -69.72 -43.53 72.16 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.204 -0.453 . . . . 65.23 110.932 179.901 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -75.21 -33.74 61.42 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.224 -0.444 . . . . 75.12 110.903 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.1 tt -74.28 -54.9 6.73 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.132 -0.485 . . . . 74.41 110.918 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -52.17 -28.53 26.56 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.739 -0.743 . . . . 73.4 112.467 179.91 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 94.9 m -70.84 -54.83 10.12 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.865 0.364 . . . . 72.44 111.17 -179.864 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.412 HG11 ' CD1' ' A' ' 19' ' ' PHE . 97.6 t -56.39 -46.67 82.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.171 -0.468 . . . . 75.21 111.122 179.9 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 31.3 mtp -55.96 -31.57 63.09 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.171 -0.468 . . . . 63.1 110.838 179.946 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 12.6 tpt180 -59.83 -53.32 59.28 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.265 -0.425 . . . . 73.0 110.863 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' SER . . . . . 0.578 ' OG ' HD21 ' M' ' 41' ' ' LEU . 2.2 t -61.87 -26.6 68.24 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.185 -0.462 . . . . 71.32 110.869 -179.775 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 1.01 HD13 ' HB3' ' M' ' 37' ' ' ALA . 53.8 mt -77.96 -24.62 48.08 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.126 -0.488 . . . . 53.13 110.948 179.962 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 100.84 33.08 5.13 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.755 -0.736 . . . . 40.52 112.451 179.88 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 5.0 tp-100 -130.86 105.82 8.02 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.805 0.336 . . . . 72.34 110.877 -179.902 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 59.1 t30 -109.92 76.75 1.0 Allowed Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.643 0.735 . . . . 54.44 110.923 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.75 167.97 22.9 Favored 'Trans proline' 0 C--O 1.232 0.186 0 C-N-CA 122.685 2.256 . . . . 74.21 112.359 179.933 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 69.7 p -81.62 159.95 23.9 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.199 -0.455 . . . . 63.24 111.179 -179.986 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -52.06 -40.45 61.17 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.253 -0.431 . . . . 71.14 110.858 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.17 -31.48 64.25 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.194 -0.457 . . . . 75.32 111.081 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 27.1 tt0 -69.73 -45.94 67.01 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.223 -0.444 . . . . 73.04 110.891 -179.936 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 29.2 mt -55.33 -51.61 66.18 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.152 -0.476 . . . . 60.35 110.919 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -59.7 -28.98 67.78 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.183 -0.462 . . . . 73.33 110.885 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -70.28 -49.57 48.41 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.224 -0.443 . . . . 75.3 110.871 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' MET . . . . . 0.435 ' HE2' ' HG3' ' M' ' 30' ' ' LYS . 7.5 mtp -55.46 -52.65 62.92 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.204 -0.453 . . . . 75.31 110.863 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 62.8 mt -64.4 -37.72 80.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.257 -0.429 . . . . 63.41 111.128 179.941 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 19.4 m-20 -57.28 -41.74 80.35 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.195 -0.457 . . . . 73.32 110.912 179.907 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 16.3 mm-40 -53.13 -52.75 57.69 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.167 -0.469 . . . . 74.11 110.92 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.432 HG13 ' CE1' ' M' ' 29' ' ' TYR . 16.5 m -76.02 -19.26 15.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.155 -0.475 . . . . 75.05 111.126 179.977 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 38.8 t0 -66.86 95.98 0.39 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.165 -0.47 . . . . 45.42 110.856 179.931 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.21 -42.0 12.59 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.125 -0.488 . . . . 74.34 111.091 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -82.2 -0.15 43.76 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.245 -0.434 . . . . 62.54 110.864 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 53.62 60.86 7.67 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.763 -0.732 . . . . 71.33 112.489 -179.933 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 52.3 p-10 -114.49 -15.81 12.0 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.876 0.37 . . . . 73.15 110.889 -179.893 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 89.59 19.65 47.69 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.773 -0.727 . . . . 63.42 112.513 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' THR . . . . . 0.681 ' CG2' HG22 ' A' ' 28' ' ' THR . 33.4 p -152.07 156.78 40.59 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.763 0.316 . . . . 62.44 111.148 -179.829 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.498 ' CD1' HD21 ' M' ' 31' ' ' LEU . 18.4 mt -93.37 111.04 24.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.209 -0.451 . . . . 74.43 111.123 179.921 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -75.72 -172.91 2.03 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.154 -0.475 . . . . 73.23 110.842 179.862 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.53 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 2.4 t80 -65.43 -58.28 12.42 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.633 0.73 . . . . 60.23 110.849 -179.855 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' PRO . . . . . 0.53 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 54.0 Cg_endo -69.7 -26.84 27.46 Favored 'Trans proline' 0 C--N 1.342 0.201 0 C-N-CA 122.64 2.227 . . . . 62.32 112.385 179.987 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 22.9 mt-10 -62.59 -39.99 95.49 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.21 -0.45 . . . . 72.44 110.872 -179.976 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 13.2 t80 -74.71 -35.71 62.7 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.14 -0.482 . . . . 72.42 110.882 -179.896 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.556 HD13 ' CB ' ' A' ' 12' ' ' PHE . 39.8 tp -70.56 -54.2 13.03 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.16 -0.473 . . . . 61.15 110.896 180.0 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 14.2 t -51.63 -30.4 21.31 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.165 -0.47 . . . . 71.54 111.176 179.938 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 37.3 ttp -59.71 -49.94 75.79 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.194 -0.457 . . . . 60.21 110.899 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' MET . . . . . 0.496 ' HE2' HG21 ' M' ' 35' ' ' VAL . 3.1 mmt -70.83 -25.81 63.01 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.184 -0.462 . . . . 71.42 110.872 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -72.01 -34.58 68.97 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.212 -0.449 . . . . 55.14 111.132 179.902 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 19.5 ttm-85 -57.16 -24.2 52.65 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.216 -0.447 . . . . 74.34 110.85 -179.912 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.3 -28.27 27.28 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.213 -0.449 . . . . 73.31 110.907 179.967 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -51.89 -61.95 1.94 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.209 -0.45 . . . . 72.21 110.852 179.864 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 31.5 mmtp -152.19 -177.95 6.5 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.218 -0.446 . . . . 74.55 110.906 -179.992 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 21.7 m-20 63.29 162.34 0.1 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.241 -0.436 . . . . 75.41 110.863 179.84 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 94.6 m 60.11 85.97 0.1 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.221 -0.445 . . . . 65.22 111.148 -179.901 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -146.25 -42.58 0.2 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.209 -0.451 . . . . 65.34 110.852 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 3.8 p -52.01 -31.0 27.78 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.151 -0.477 . . . . 72.12 110.84 -179.795 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.472 ' HA ' HD12 ' A' ' 85' ' ' ILE . 1.8 tp10 -58.67 -43.3 89.84 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.129 -0.487 . . . . 75.22 110.889 -179.917 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -57.08 -42.11 80.07 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.127 -0.488 . . . . 65.3 110.883 -179.949 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 42.1 mm-40 -60.61 -26.67 67.17 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.153 -0.476 . . . . 63.41 110.903 -179.943 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.597 HD13 HG13 ' A' ' 142' ' ' VAL . 65.3 mt -73.99 -45.36 48.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.165 -0.47 . . . . 64.43 111.142 179.955 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 34.2 ttt-85 -71.24 -45.41 63.33 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.195 -0.457 . . . . 71.3 110.841 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.729 ' O ' HG23 ' A' ' 91' ' ' VAL . 10.2 tp10 -60.65 -53.77 53.38 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.222 -0.445 . . . . 74.42 110.893 -179.906 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -53.45 -47.85 69.34 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.183 -0.462 . . . . 22.12 111.088 179.896 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 3.0 t80 -52.09 -46.87 65.41 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.22 -0.446 . . . . 73.11 110.865 -179.899 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 22.5 ttm-85 -69.07 -31.71 70.66 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.154 -0.475 . . . . 71.44 110.863 -179.919 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' VAL . . . . . 0.729 HG23 ' O ' ' A' ' 87' ' ' GLU . 92.5 t -68.92 -27.34 35.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.163 -0.471 . . . . 74.52 111.121 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 17.9 m-85 -96.35 -26.59 15.31 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.183 -0.462 . . . . 73.13 110.899 179.975 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 29.6 t0 -69.48 94.57 0.76 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.141 -0.481 . . . . 71.53 110.913 179.922 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 9.7 ttmm -78.47 -52.82 7.97 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.223 -0.444 . . . . 74.25 110.895 -179.994 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 50.3 p30 -72.52 -9.14 58.2 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.176 -0.466 . . . . 71.13 110.789 179.938 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 60.17 27.64 65.43 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.77 -0.729 . . . . 75.22 112.464 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 39.6 p-10 -82.85 -16.22 48.5 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.879 0.371 . . . . 72.33 110.901 -179.942 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 86.47 18.67 58.35 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.748 -0.739 . . . . 70.35 112.473 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 12.4 m-85 -140.47 145.37 36.85 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.852 0.358 . . . . 72.42 110.929 -179.819 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 66.7 mt -111.5 127.02 68.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.119 -0.492 . . . . 75.31 111.13 179.93 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 26.4 p -117.0 174.67 5.97 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.155 -0.475 . . . . 62.21 110.853 -179.893 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -60.03 -30.02 68.9 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.15 -0.477 . . . . 61.54 111.113 179.912 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -69.93 -46.12 66.03 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.215 -0.448 . . . . 63.43 111.089 179.931 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 55.5 mt-10 -72.5 -46.61 53.89 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.218 -0.446 . . . . 74.42 110.881 -179.893 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.667 HD21 ' HE2' ' A' ' 124' ' ' MET . 44.1 tp -55.84 -46.54 78.15 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.187 -0.461 . . . . 74.12 110.951 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 106' ' ' ARG . . . . . 0.671 ' HB2' HG21 ' A' ' 121' ' ' VAL . 56.8 ttp85 -58.31 -33.76 69.84 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.168 -0.469 . . . . 71.44 110.9 179.886 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 79.6 t60 -72.18 -36.4 69.25 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.176 -0.465 . . . . 73.5 110.836 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 83.8 t -66.78 -40.82 86.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.2 -0.454 . . . . 74.2 111.124 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 109' ' ' MET . . . . . 0.645 ' HE2' HD11 ' M' ' 19' ' ' ILE . 11.2 mmt -64.15 -27.9 69.39 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.183 -0.462 . . . . 73.43 110.883 179.91 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 1.5 m -66.08 -42.0 89.95 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.244 -0.435 . . . . 75.1 111.145 -179.923 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 33.4 t30 -58.63 -34.3 71.02 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.283 -0.417 . . . . 70.44 110.922 179.975 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 18.0 mt -73.25 -26.22 61.02 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.158 -0.474 . . . . 72.44 110.918 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 100.48 31.1 5.94 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.723 -0.751 . . . . 54.24 112.508 179.929 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -108.73 114.68 28.67 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.903 0.382 . . . . 74.31 110.88 -179.855 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.4 102.03 2.09 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.116 -0.493 . . . . 73.34 110.899 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.477 HD12 ' CB ' ' A' ' 109' ' ' MET . 11.1 mt -133.21 146.81 51.82 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.215 -0.448 . . . . 62.32 110.894 179.948 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 117' ' ' THR . . . . . 0.541 ' O ' HG23 ' A' ' 121' ' ' VAL . 29.2 p -108.51 -175.39 2.76 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.141 -0.481 . . . . 63.04 111.115 179.949 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 72.6 m-20 -65.57 -38.91 90.92 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.169 -0.468 . . . . 73.24 110.878 179.916 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -65.43 -33.47 76.03 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.176 -0.465 . . . . 73.11 110.93 -179.929 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 19.0 tt0 -72.11 -49.8 33.28 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.12 -0.491 . . . . 72.53 110.905 -179.909 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.671 HG21 ' HB2' ' A' ' 106' ' ' ARG . 58.3 t -54.45 -31.16 22.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.175 -0.466 . . . . 71.22 111.131 179.937 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -51.94 -42.7 63.04 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.193 -0.458 . . . . 52.22 110.879 179.948 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 11.4 tp10 -62.94 -31.4 72.48 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.164 -0.471 . . . . 74.43 110.905 -179.909 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 124' ' ' MET . . . . . 0.667 ' HE2' HD21 ' A' ' 105' ' ' LEU . 94.8 mtp -72.99 -59.47 2.69 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.098 -0.501 . . . . 74.31 110.869 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 35.9 mm -53.99 -35.59 28.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.208 -0.451 . . . . 73.44 111.146 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 39.1 ttt85 -63.33 -31.9 73.18 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.199 -0.455 . . . . 73.14 110.898 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 19.3 tp10 -74.85 -52.37 11.52 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.137 -0.483 . . . . 74.41 110.871 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.653 ' HB3' HG22 ' A' ' 136' ' ' VAL . . . -65.11 -34.43 78.38 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.185 -0.461 . . . . 35.24 111.102 179.967 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 49.4 t0 -68.4 86.77 0.29 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.167 -0.47 . . . . 75.1 110.862 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 58.0 mt -79.83 -46.23 22.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.184 -0.462 . . . . 73.22 111.085 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 21.2 p30 -72.76 -8.67 56.58 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.176 -0.465 . . . . 62.45 110.84 179.89 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 62.71 42.99 99.61 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.745 -0.741 . . . . 54.14 112.5 -179.914 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 34.8 p-10 -88.08 -15.95 34.86 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.881 0.372 . . . . 75.14 110.89 -179.976 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 104.1 2.36 45.16 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.733 -0.746 . . . . 60.05 112.496 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 5.6 tt0 -149.19 172.24 15.15 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.858 0.361 . . . . 73.44 110.906 -179.85 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 136' ' ' VAL . . . . . 0.653 HG22 ' HB3' ' A' ' 128' ' ' ALA . 94.6 t -107.51 111.31 35.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.233 -0.44 . . . . 72.22 111.125 179.935 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 44.0 p-10 -92.5 166.13 12.68 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.136 -0.484 . . . . 44.22 110.934 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 138' ' ' TYR . . . . . 0.609 ' O ' HG23 ' A' ' 142' ' ' VAL . 78.1 t80 -51.96 -46.72 64.89 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.203 -0.453 . . . . 75.13 110.961 -179.93 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -51.98 -41.04 61.84 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.092 -0.504 . . . . 75.35 110.913 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -78.44 -36.26 45.7 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.14 -0.482 . . . . 75.14 110.873 -179.92 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 66.0 t80 -64.67 -35.51 81.27 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.136 -0.484 . . . . 51.24 110.87 -179.938 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 142' ' ' VAL . . . . . 0.609 HG23 ' O ' ' A' ' 138' ' ' TYR . 94.4 t -69.77 -38.5 76.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.169 -0.468 . . . . 64.14 111.094 -179.982 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 45.0 tt0 -71.37 -36.56 71.49 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.19 -0.459 . . . . 73.2 110.926 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 5.7 tpt -72.81 -29.16 63.03 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.194 -0.457 . . . . 73.31 110.881 179.969 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -84.32 -27.91 27.45 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.24 -0.436 . . . . 74.05 110.846 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 87.6 m -86.75 -30.19 21.79 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.231 -0.44 . . . . 63.22 111.108 -179.898 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -101.1 172.71 6.84 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.225 -0.443 . . . . 65.24 111.078 179.917 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 86.0 tttt . . . . . 0 C--N 1.328 -0.337 0 CA-C-N 116.218 -0.446 . . . . 72.41 110.904 179.965 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' M' M ' 8' ' ' LEU . . . . . . . . . . . . . 4.3 mm? . . . . . 0 C--O 1.231 0.092 0 CA-C-O 120.841 0.353 . . . . 74.33 110.903 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' M' M ' 9' ' ' SER . . . . . . . . . . . . . 9.4 p -114.45 -61.57 1.73 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.167 -0.47 . . . . 64.24 110.871 -179.932 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' M' M ' 10' ' ' GLY . . . . . . . . . . . . . . . 177.58 176.25 45.47 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.744 -0.741 . . . . 54.35 112.461 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' M' M ' 11' ' ' GLY . . . . . . . . . . . . . . . 161.56 -105.23 0.25 Allowed Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.72 -0.752 . . . . 73.15 112.479 -179.895 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' M' M ' 12' ' ' GLU . . . . . . . . . . . . . 1.1 pm0 -111.15 177.9 4.51 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.864 0.364 . . . . 73.53 110.876 -179.886 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' M' M ' 13' ' ' LEU . . . . . 0.477 ' O ' HD23 ' M' ' 13' ' ' LEU . 10.1 tt -65.04 98.19 0.28 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.162 -0.472 . . . . 65.12 110.923 -179.934 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' M' M ' 14' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -103.1 25.78 9.04 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.199 -0.455 . . . . 63.05 110.854 179.87 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' M' M ' 15' ' ' LYS . . . . . . . . . . . . . 20.0 mttm -79.13 -44.51 21.84 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.197 -0.456 . . . . 74.43 110.871 179.95 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' M' M ' 16' ' ' TRP . . . . . 0.623 ' CE3' HD12 ' M' ' 19' ' ' ILE . 7.2 m95 -52.1 -45.9 65.05 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.257 -0.429 . . . . 75.45 110.931 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' M' M ' 17' ' ' GLU . . . . . . . . . . . . . 15.8 tm-20 -57.52 -27.2 62.38 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.211 -0.449 . . . . 71.25 110.897 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' M' M ' 18' ' ' LYS . . . . . . . . . . . . . 8.9 ttmm -69.93 -27.6 64.9 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.158 -0.473 . . . . 74.51 110.859 179.989 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' M' M ' 19' ' ' ILE . . . . . 0.645 HD11 ' HE2' ' A' ' 109' ' ' MET . 34.3 mt -83.09 -25.22 8.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.245 -0.434 . . . . 64.21 111.146 179.863 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' M' M ' 20' ' ' ARG . . . . . . . . . . . . . 22.7 ttp180 -71.27 -26.16 62.76 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.171 -0.468 . . . . 75.33 110.853 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' M' M ' 21' ' ' LEU . . . . . . . . . . . . . 9.9 mt 62.98 -176.83 0.15 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.223 -0.444 . . . . 72.33 110.898 -179.994 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' M' M ' 22' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -82.83 158.56 64.94 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.628 0.728 . . . . 62.52 110.866 179.979 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' M' M ' 23' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.71 124.06 10.73 Favored 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.718 2.278 . . . . 71.0 112.354 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' M' M ' 24' ' ' GLY . . . . . . . . . . . . . . . 146.19 138.36 3.19 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.737 -0.744 . . . . 73.11 112.462 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' M' M ' 25' ' ' GLY . . . . . . . . . . . . . . . 175.86 -169.57 42.28 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.774 -0.727 . . . . 73.31 112.512 -179.911 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' M' M ' 26' ' ' LYS . . . . . . . . . . . . . 4.6 mmmm -85.55 160.7 19.59 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.845 0.355 . . . . 61.41 110.912 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' M' M ' 27' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.99 142.03 35.51 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.241 -0.436 . . . . 65.22 110.868 179.899 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' M' M ' 28' ' ' GLN . . . . . . . . . . . . . 4.4 tm0? -166.45 135.27 2.96 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.243 -0.435 . . . . 74.43 110.923 179.933 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' M' M ' 29' ' ' TYR . . . . . 0.432 ' CE1' HG13 ' A' ' 55' ' ' VAL . 1.0 OUTLIER -97.01 158.59 15.35 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.261 -0.427 . . . . 74.52 110.941 -179.881 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' M' M ' 30' ' ' LYS . . . . . 0.435 ' HG3' ' HE2' ' A' ' 51' ' ' MET . 17.8 tptt -92.99 44.78 1.16 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.094 -0.503 . . . . 72.33 110.946 179.906 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' M' M ' 31' ' ' LEU . . . . . 0.498 HD21 ' CD1' ' A' ' 63' ' ' ILE . 18.9 tp -179.76 -39.07 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.212 -0.449 . . . . 73.31 110.896 179.912 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' M' M ' 32' ' ' LYS . . . . . . . . . . . . . 1.6 tmtt? -50.26 -40.95 49.52 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.23 -0.441 . . . . 74.41 110.907 179.849 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' M' M ' 33' ' ' HIS . . . . . . . . . . . . . 83.9 t60 -50.25 -38.68 41.99 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.23 -0.441 . . . . 51.51 110.894 179.842 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' M' M ' 34' ' ' ILE . . . . . . . . . . . . . 48.8 mm -50.13 -39.77 16.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.2 -0.455 . . . . 71.11 111.102 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' M' M ' 35' ' ' VAL . . . . . 0.496 HG21 ' HE2' ' A' ' 72' ' ' MET . 97.0 t -49.16 -40.18 13.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.228 -0.442 . . . . 74.12 111.1 179.869 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' M' M ' 36' ' ' TRP . . . . . . . . . . . . . 24.7 m0 -58.57 -39.67 80.98 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.196 -0.456 . . . . 73.3 110.906 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' M' M ' 37' ' ' ALA . . . . . 1.01 ' HB3' HD13 ' A' ' 39' ' ' LEU . . . -63.99 -18.69 64.54 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.25 -0.432 . . . . 72.32 111.095 179.864 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' M' M ' 38' ' ' SER . . . . . . . . . . . . . 1.6 m -71.94 -17.93 62.05 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.278 -0.419 . . . . 64.01 110.876 -179.808 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' M' M ' 39' ' ' ARG . . . . . . . . . . . . . 3.5 tpt180 -57.56 -25.43 59.96 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.122 -0.49 . . . . 62.42 110.885 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' M' M ' 40' ' ' GLU . . . . . . . . . . . . . 12.4 mt-10 -85.94 -48.12 9.0 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.182 -0.463 . . . . 75.33 110.897 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' M' M ' 41' ' ' LEU . . . . . 0.578 HD21 ' OG ' ' A' ' 38' ' ' SER . 9.8 mt -63.22 137.83 58.34 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.153 -0.476 . . . . 73.22 110.919 -179.941 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' M' M ' 42' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -64.32 160.11 19.57 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.188 -0.46 . . . . 73.05 110.898 179.916 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' M' M ' 43' ' ' ARG . . . . . . . . . . . . . 45.8 ttp180 . . . . . 0 C--N 1.329 -0.299 0 CA-C-N 116.088 -0.505 . . . . 73.35 110.873 -179.919 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 241' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 262' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 301' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 322' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.107 0 CA-C-O 120.788 0.328 . . . . 73.25 111.117 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 2.9 p-10 -165.48 84.49 0.36 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.24 -0.436 . . . . 73.44 110.879 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 6.9 pt20 -81.95 -172.2 3.79 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.185 -0.461 . . . . 64.31 110.886 -179.909 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 35.7 mt -87.33 131.08 34.38 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.217 -0.447 . . . . 41.13 110.92 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 77.4 p -102.74 167.78 9.67 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.16 -0.473 . . . . 70.44 111.119 179.961 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -52.18 -38.51 57.97 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.176 -0.465 . . . . 63.32 110.877 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -64.89 -32.12 73.68 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.178 -0.464 . . . . 74.54 110.866 -179.893 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 16.5 tp60 -77.62 -48.79 15.99 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.121 -0.49 . . . . 74.13 110.873 -179.905 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 72.0 mt -65.45 -47.25 87.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.201 -0.454 . . . . 75.51 111.112 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -56.23 -26.48 51.47 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.162 -0.472 . . . . 53.2 111.097 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -71.43 -44.31 65.11 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.227 -0.442 . . . . 62.13 110.882 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 26.1 m-85 -75.78 -45.9 33.69 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.207 -0.451 . . . . 73.44 110.876 -179.941 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 25.6 ttmt -55.47 -26.09 40.46 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.176 -0.466 . . . . 62.52 110.871 179.998 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 16.4 mm-40 -71.91 -40.25 68.97 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.24 -0.436 . . . . 71.34 110.889 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -60.1 -39.21 85.36 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.14 -0.482 . . . . 72.14 111.123 179.907 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 54.7 t80 -53.04 -52.02 59.86 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.193 -0.458 . . . . 75.44 110.909 -179.945 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 6.1 t -54.59 -30.37 54.32 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.171 -0.468 . . . . 74.15 110.852 -179.797 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.571 HD23 ' HB3' ' M' ' 38' ' ' SER . 15.5 tp -66.36 -45.04 81.49 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.089 -0.505 . . . . 74.22 110.929 179.991 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 57.3 m-85 -75.2 -26.21 58.81 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.235 -0.439 . . . . 72.2 110.896 179.898 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 12.9 t0 -78.27 98.56 5.95 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.108 -0.496 . . . . 61.34 110.884 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 1.3 tppp? -68.23 -51.97 39.33 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.178 -0.465 . . . . 54.34 110.894 -179.989 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 23.5 p-10 -79.51 -10.07 59.73 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.225 -0.443 . . . . 63.43 110.815 179.933 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 52.11 42.35 54.83 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.771 -0.728 . . . . 50.02 112.468 -179.938 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 19.6 p-10 -88.73 -15.69 34.12 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.896 0.379 . . . . 54.41 110.871 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 104.64 16.72 16.74 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.758 -0.734 . . . . 32.24 112.524 -179.955 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -154.64 130.71 10.25 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.76 0.314 . . . . 75.53 111.13 -179.834 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 29.3 mt -89.18 123.77 41.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.252 -0.431 . . . . 62.34 111.108 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.521 ' HA ' HG22 ' A' ' 62' ' ' THR . 43.5 p -98.58 -177.36 3.65 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.148 -0.478 . . . . 75.24 111.151 179.954 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.85 HG22 HD12 ' A' ' 52' ' ' ILE . 49.4 p -71.5 -39.56 70.75 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.235 -0.439 . . . . 74.14 111.171 -179.998 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 45.2 mmtt -68.9 -50.09 52.57 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.192 -0.458 . . . . 75.45 110.881 179.906 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.607 ' O ' HG23 ' A' ' 35' ' ' VAL . 32.8 mt-10 -59.19 -38.91 80.99 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.219 -0.446 . . . . 64.0 110.896 179.98 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.2 tt -74.3 -56.2 5.15 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.16 -0.473 . . . . 75.01 110.921 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -52.26 -44.42 57.83 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.748 -0.739 . . . . 74.14 112.46 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 92.4 m -56.49 -47.25 79.65 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.831 0.348 . . . . 65.02 111.165 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.607 HG23 ' O ' ' A' ' 31' ' ' GLU . 97.0 t -62.78 -51.11 76.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.197 -0.456 . . . . 73.04 111.13 179.937 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 21.4 mtp -51.91 -33.87 38.93 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.185 -0.461 . . . . 70.34 110.891 179.87 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 59.0 ttt85 -57.07 -54.59 45.01 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.271 -0.422 . . . . 70.22 110.906 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' SER . . . . . 0.653 ' OG ' HD21 ' M' ' 41' ' ' LEU . 1.7 t -60.98 -26.22 67.41 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.196 -0.456 . . . . 41.13 110.879 -179.836 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.992 HD13 ' HB3' ' M' ' 37' ' ' ALA . 69.7 mt -79.73 -18.91 50.04 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.137 -0.483 . . . . 62.33 110.904 179.972 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 101.55 28.85 6.51 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.753 -0.737 . . . . 71.4 112.519 179.931 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 2.9 tt0 -128.69 106.5 8.98 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.776 0.322 . . . . 72.41 110.901 -179.84 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 6.0 t-20 -109.86 76.9 1.0 Allowed Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.625 0.726 . . . . 71.24 110.868 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.72 158.99 55.11 Favored 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.711 2.274 . . . . 53.22 112.361 179.903 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 66.4 p -76.61 160.19 29.63 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.217 -0.447 . . . . 73.51 111.159 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 7.9 mt-10 -51.97 -39.52 59.45 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.172 -0.467 . . . . 73.14 110.933 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.26 -31.57 64.17 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.126 -0.488 . . . . 72.54 111.111 179.895 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 59.8 tt0 -69.71 -47.94 61.33 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.187 -0.461 . . . . 72.55 110.919 -179.941 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 29.3 mt -55.34 -51.84 65.47 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.126 -0.488 . . . . 74.34 110.892 -179.961 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 41.4 tp60 -60.05 -28.99 68.23 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.255 -0.43 . . . . 51.05 110.955 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 39.3 t0 -67.13 -46.61 73.59 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.161 -0.472 . . . . 63.42 110.853 179.926 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' MET . . . . . 0.583 ' HB3' HD22 ' M' ' 31' ' ' LEU . 10.9 mtp -58.72 -58.03 10.37 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.215 -0.448 . . . . 71.51 110.872 179.99 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.85 HD12 HG22 ' A' ' 29' ' ' THR . 74.1 mt -56.53 -37.56 52.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.224 -0.444 . . . . 74.42 111.148 179.976 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 63.9 m-20 -69.74 -34.63 74.11 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.17 -0.468 . . . . 64.3 110.883 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 25.5 mt-10 -61.57 -30.92 70.97 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.168 -0.469 . . . . 71.25 110.912 179.973 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.422 HG13 ' CE1' ' M' ' 29' ' ' TYR . 6.5 m -109.17 17.99 6.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.144 -0.48 . . . . 70.51 111.121 179.995 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 32.3 t0 -90.11 97.25 11.08 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.176 -0.466 . . . . 72.45 110.865 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.13 -45.32 10.23 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.151 -0.477 . . . . 72.41 111.09 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 19.8 p-10 -81.85 -0.09 41.94 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.256 -0.429 . . . . 72.12 110.86 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 54.35 57.31 17.65 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.736 -0.745 . . . . 74.14 112.484 -179.943 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 48.3 p-10 -114.48 -15.71 12.01 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.877 0.37 . . . . 45.51 110.902 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 90.28 21.94 36.57 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.773 -0.727 . . . . 63.13 112.489 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' THR . . . . . 0.521 HG22 ' HA ' ' A' ' 28' ' ' THR . 76.0 p -150.94 165.07 34.82 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.731 0.301 . . . . 54.14 111.119 -179.86 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 28.0 mt -94.61 114.44 31.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.187 -0.461 . . . . 73.43 111.099 179.891 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -78.41 -172.91 3.07 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.168 -0.469 . . . . 72.31 110.871 179.838 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.532 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 2.5 t80 -63.97 -58.4 14.75 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-O 121.672 0.748 . . . . 63.14 110.895 -179.902 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' PRO . . . . . 0.532 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 53.8 Cg_endo -69.7 -32.08 19.54 Favored 'Trans proline' 0 C--N 1.341 0.136 0 C-N-CA 122.724 2.283 . . . . 63.34 112.387 179.985 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 74.1 mt-10 -57.25 -42.67 81.94 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.166 -0.47 . . . . 63.43 110.907 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 78.7 t80 -70.83 -36.45 72.92 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.13 -0.486 . . . . 71.4 110.9 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 15.4 tp -67.53 -53.7 26.26 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.136 -0.484 . . . . 74.53 110.973 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 14.9 t -57.24 -29.43 63.78 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.16 -0.473 . . . . 74.15 111.185 179.899 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 45.8 ttp -61.15 -42.32 98.35 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.176 -0.466 . . . . 71.33 110.898 179.901 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 8.8 mtt -79.78 -45.91 17.95 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.217 -0.447 . . . . 72.14 110.918 179.939 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -53.1 -30.98 39.52 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.215 -0.448 . . . . 74.11 111.086 179.886 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.42 -27.63 64.48 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.261 -0.427 . . . . 74.25 110.873 -179.941 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.83 -32.33 70.56 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.191 -0.459 . . . . 75.11 110.878 -179.992 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 70.8 mtp -53.85 -61.68 2.15 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.232 -0.44 . . . . 64.24 110.898 179.844 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -123.61 137.54 54.72 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.239 -0.437 . . . . 75.24 110.909 179.955 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 8.3 p-10 -125.85 -171.41 2.38 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.275 -0.42 . . . . 74.12 110.832 179.907 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 1.9 m -64.96 -30.54 71.53 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.174 -0.466 . . . . 73.31 111.118 -179.904 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 33.2 m-20 -55.53 -26.17 41.56 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.262 -0.426 . . . . 55.24 110.881 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 12.5 t -52.08 -40.68 61.57 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.146 -0.479 . . . . 72.11 110.893 -179.777 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -60.89 -33.55 73.28 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.129 -0.487 . . . . 75.31 110.863 -179.954 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 12.0 tt0 -64.38 -44.49 91.18 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.18 -0.463 . . . . 73.23 110.87 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -57.7 -27.1 62.63 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.147 -0.479 . . . . 72.42 110.898 -179.935 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.62 ' CG2' HG22 ' A' ' 142' ' ' VAL . 57.8 mt -73.89 -48.9 37.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.124 -0.489 . . . . 73.33 111.091 -179.971 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 46.3 ttp180 -71.65 -28.22 63.61 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.181 -0.463 . . . . 74.24 110.897 179.959 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.681 ' O ' HG23 ' A' ' 91' ' ' VAL . 4.1 tp10 -71.89 -29.14 64.03 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.164 -0.471 . . . . 71.52 110.888 -179.914 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 88' ' ' ALA . . . . . 0.467 ' HB1' ' CE2' ' A' ' 92' ' ' PHE . . . -76.35 -35.64 58.62 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.14 -0.482 . . . . 63.41 111.096 179.949 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 3.9 t80 -56.82 -49.31 75.79 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.196 -0.456 . . . . 74.03 110.863 -179.904 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 10.5 ptm180 -62.82 -26.16 68.6 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.102 -0.499 . . . . 71.33 110.888 -179.886 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' VAL . . . . . 0.681 HG23 ' O ' ' A' ' 87' ' ' GLU . 91.8 t -74.0 -45.74 47.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.201 -0.454 . . . . 75.21 111.156 179.951 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.467 ' CE2' ' HB1' ' A' ' 88' ' ' ALA . 9.5 m-85 -75.54 -34.76 60.78 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.126 -0.488 . . . . 74.14 110.864 -179.993 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 28.5 t0 -64.52 93.05 0.09 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.175 -0.466 . . . . 63.41 110.867 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 1.5 ttmp? -78.71 -52.75 7.96 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.175 -0.466 . . . . 65.21 110.883 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 54.1 p-10 -72.71 -9.08 58.21 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.201 -0.454 . . . . 43.2 110.854 179.911 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 60.97 33.53 84.21 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.759 -0.734 . . . . 54.2 112.517 -179.943 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 40.7 p-10 -85.52 -16.22 40.22 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.876 0.37 . . . . 72.1 110.896 -179.9 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 85.87 18.63 59.37 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.732 -0.747 . . . . 60.55 112.497 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 14.5 m-85 -140.75 151.01 44.11 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.833 0.349 . . . . 53.04 110.947 -179.799 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 64.0 mt -115.82 127.24 73.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.144 -0.48 . . . . 63.01 111.172 179.877 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 89.4 p -116.62 -171.47 2.02 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.186 -0.461 . . . . 61.12 110.836 -179.87 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -68.61 -44.77 73.58 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.133 -0.485 . . . . 70.3 111.085 179.947 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -63.8 -38.01 89.51 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.223 -0.444 . . . . 62.51 111.063 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 23.6 mt-10 -76.04 -52.07 10.96 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.216 -0.447 . . . . 74.2 110.858 -179.889 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.667 HD21 ' HG2' ' A' ' 124' ' ' MET . 35.2 tp -53.37 -52.42 59.31 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.192 -0.458 . . . . 70.0 110.952 179.998 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 50.8 ttt180 -52.27 -43.48 64.41 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.187 -0.46 . . . . 75.12 110.883 179.934 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 77.6 t60 -54.27 -34.43 60.81 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.147 -0.478 . . . . 74.23 110.893 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 92.8 t -70.25 -48.28 62.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.18 -0.463 . . . . 74.23 111.133 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 109' ' ' MET . . . . . 0.614 ' HG2' HD11 ' A' ' 116' ' ' LEU . 0.2 OUTLIER -64.4 -28.23 69.54 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.186 -0.461 . . . . 71.24 110.877 179.885 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 15.6 m -62.53 -30.95 71.66 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.238 -0.437 . . . . 70.22 111.145 -179.936 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -74.71 -25.34 59.06 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.258 -0.428 . . . . 72.43 110.899 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -70.63 -25.68 63.14 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.137 -0.483 . . . . 64.13 110.948 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 99.62 19.77 19.22 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.747 -0.739 . . . . 61.2 112.466 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -103.44 112.86 25.96 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.961 0.41 . . . . 72.41 110.862 -179.845 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 16.2 mtpp -65.07 124.59 22.51 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.167 -0.47 . . . . 74.14 110.86 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.614 HD11 ' HG2' ' A' ' 109' ' ' MET . 5.2 mt -138.65 160.51 39.46 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.234 -0.439 . . . . 75.32 110.883 179.909 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 34.5 p -118.87 167.61 11.55 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.161 -0.472 . . . . 63.44 111.113 179.976 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 51.8 m-20 -52.34 -35.83 51.9 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.24 -0.437 . . . . 75.2 110.882 179.915 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 84.4 tt0 -72.81 -35.34 67.31 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.18 -0.464 . . . . 64.4 110.916 -179.92 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 36.2 tp10 -64.8 -44.54 89.59 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.138 -0.483 . . . . 63.13 110.872 -179.919 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 58.3 t -57.44 -40.46 74.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.159 -0.473 . . . . 70.01 111.092 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -52.2 -49.82 63.13 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.235 -0.439 . . . . 64.22 110.83 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 123' ' ' GLU . . . . . 0.588 ' HG2' HD23 ' M' ' 13' ' ' LEU . 15.7 tp10 -55.8 -29.43 59.71 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.21 -0.45 . . . . 74.43 110.93 -179.947 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 124' ' ' MET . . . . . 0.667 ' HG2' HD21 ' A' ' 105' ' ' LEU . 2.9 ttt -72.65 -59.87 2.51 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.149 -0.478 . . . . 65.35 110.876 -179.973 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.49 HG23 HG23 ' A' ' 136' ' ' VAL . 33.7 mm -54.25 -35.72 30.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.229 -0.441 . . . . 75.44 111.129 179.943 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 40.8 ttt180 -63.41 -31.79 73.04 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.172 -0.467 . . . . 75.24 110.869 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 12.2 tm-20 -72.85 -50.65 22.67 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.169 -0.469 . . . . 74.33 110.932 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.562 ' HB3' ' CG2' ' A' ' 136' ' ' VAL . . . -69.68 -26.83 64.56 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.145 -0.48 . . . . 44.55 111.091 179.96 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 51.2 t0 -75.04 86.49 2.34 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.241 -0.436 . . . . 73.05 110.853 179.953 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 130' ' ' ILE . . . . . 0.775 HD12 ' HG2' ' A' ' 140' ' ' GLU . 4.9 mt -79.89 -45.19 22.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.215 -0.448 . . . . 72.02 111.139 179.972 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 18.2 p30 -72.42 -8.9 57.46 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.206 -0.452 . . . . 60.3 110.853 179.843 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 62.64 43.95 98.24 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.705 -0.759 . . . . 64.54 112.455 -179.927 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 33.7 p-10 -89.56 -15.96 31.71 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.858 0.361 . . . . 73.15 110.839 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 101.63 3.86 52.62 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.719 -0.753 . . . . 44.04 112.526 -179.931 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 4.7 tt0 -149.2 172.23 15.17 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.796 0.332 . . . . 73.12 110.918 -179.863 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 136' ' ' VAL . . . . . 0.562 ' CG2' ' HB3' ' A' ' 128' ' ' ALA . 95.9 t -114.08 111.49 36.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.197 -0.456 . . . . 65.15 111.131 179.934 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 14.7 p30 -91.46 170.96 9.53 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.215 -0.448 . . . . 74.15 110.909 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 45.5 t80 -55.01 -47.37 74.76 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.141 -0.481 . . . . 74.04 110.953 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -52.25 -50.62 61.7 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.112 -0.494 . . . . 72.04 110.879 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 140' ' ' GLU . . . . . 0.775 ' HG2' HD12 ' A' ' 130' ' ' ILE . 95.6 mt-10 -66.77 -31.72 72.55 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.152 -0.476 . . . . 64.23 110.885 -179.911 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 49.8 t80 -67.61 -50.18 59.4 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.147 -0.479 . . . . 74.2 110.861 -179.946 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 142' ' ' VAL . . . . . 0.62 HG22 ' CG2' ' A' ' 85' ' ' ILE . 73.0 t -62.79 -38.5 81.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.172 -0.467 . . . . 75.22 111.102 -179.973 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 143' ' ' GLN . . . . . 0.442 ' OE1' HD13 ' A' ' 130' ' ' ILE . 64.6 tt0 -57.46 -36.71 71.8 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.183 -0.462 . . . . 73.42 110.941 179.99 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 11.5 tpt -74.3 -55.47 5.98 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.182 -0.463 . . . . 74.33 110.896 179.938 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 21.0 ttm -59.42 -22.44 61.45 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.225 -0.443 . . . . 74.12 110.865 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 94.8 m -91.05 -41.73 10.91 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.249 -0.432 . . . . 71.15 111.167 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -95.8 -75.64 0.52 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.206 -0.452 . . . . 55.33 111.153 179.842 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 116.179 -0.464 . . . . 72.52 110.889 179.968 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' M' M ' 8' ' ' LEU . . . . . . . . . . . . . 2.1 pt? . . . . . 0 C--O 1.231 0.108 0 CA-C-O 120.835 0.35 . . . . 70.24 110.944 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' M' M ' 9' ' ' SER . . . . . . . . . . . . . 3.1 m -90.62 78.19 6.29 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.206 -0.452 . . . . 51.11 110.895 -179.955 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' M' M ' 10' ' ' GLY . . . . . . . . . . . . . . . -167.62 154.3 24.34 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.755 -0.736 . . . . 75.52 112.516 -179.97 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' M' M ' 11' ' ' GLY . . . . . . . . . . . . . . . 106.8 -29.21 11.15 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.716 -0.754 . . . . 72.41 112.513 -179.9 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' M' M ' 12' ' ' GLU . . . . . . . . . . . . . 17.4 pt-20 -66.02 -174.26 0.23 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.895 0.379 . . . . 73.51 110.904 -179.922 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' M' M ' 13' ' ' LEU . . . . . 0.588 HD23 ' HG2' ' A' ' 123' ' ' GLU . 0.9 OUTLIER -87.35 75.95 9.18 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.179 -0.464 . . . . 73.01 110.924 -179.968 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' M' M ' 14' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -102.8 25.65 9.0 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.169 -0.469 . . . . 71.54 110.827 179.887 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' M' M ' 15' ' ' LYS . . . . . . . . . . . . . 4.3 mtmp? -77.48 -34.25 54.34 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.222 -0.444 . . . . 54.22 110.895 179.976 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' M' M ' 16' ' ' TRP . . . . . 0.48 ' CZ2' ' HB2' ' A' ' 128' ' ' ALA . 44.3 m95 -51.83 -30.12 22.14 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.233 -0.439 . . . . 61.44 110.92 179.891 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' M' M ' 17' ' ' GLU . . . . . . . . . . . . . 5.4 tm-20 -54.25 -39.32 66.72 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.983 0.42 . . . . 71.41 110.911 -179.984 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' M' M ' 18' ' ' LYS . . . . . . . . . . . . . 4.8 ttpm? -62.82 -23.44 67.27 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.12 -0.491 . . . . 72.05 110.887 179.93 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' M' M ' 19' ' ' ILE . . . . . 0.422 HD11 ' HE1' ' A' ' 124' ' ' MET . 21.8 mm -70.89 -34.35 55.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.209 -0.45 . . . . 65.2 111.105 179.924 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' M' M ' 20' ' ' ARG . . . . . . . . . . . . . 25.4 ttm180 -60.8 -26.63 67.43 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.192 -0.458 . . . . 71.4 110.868 179.961 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' M' M ' 21' ' ' LEU . . . . . . . . . . . . . 6.7 mt 59.4 178.06 0.08 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.186 -0.461 . . . . 65.53 110.881 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' M' M ' 22' ' ' ARG . . . . . . . . . . . . . 19.9 mtm180 -74.74 143.8 79.09 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.587 0.708 . . . . 45.04 110.83 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' M' M ' 23' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.75 -170.93 0.42 Allowed 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.649 2.233 . . . . 64.1 112.347 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' M' M ' 24' ' ' GLY . . . . . . . . . . . . . . . 144.08 117.61 1.19 Allowed Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.771 -0.728 . . . . 62.42 112.476 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' M' M ' 25' ' ' GLY . . . . . . . . . . . . . . . 157.07 155.96 7.69 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.78 -0.724 . . . . 55.24 112.529 -179.898 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' M' M ' 26' ' ' LYS . . . . . . . . . . . . . 16.2 pttm -177.71 115.16 0.08 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.812 0.339 . . . . 64.11 110.933 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' M' M ' 27' ' ' LYS . . . . . . . . . . . . . 24.5 tptt -150.13 59.77 0.97 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.215 -0.448 . . . . 73.21 110.91 179.881 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' M' M ' 28' ' ' GLN . . . . . . . . . . . . . 1.7 tm0? -173.37 162.6 4.36 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.231 -0.44 . . . . 74.43 110.882 180.0 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' M' M ' 29' ' ' TYR . . . . . 0.422 ' CE1' HG13 ' A' ' 55' ' ' VAL . 6.3 m-85 60.03 171.8 0.08 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.163 -0.471 . . . . 71.13 110.863 -179.929 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' M' M ' 30' ' ' LYS . . . . . . . . . . . . . 8.1 pttm -178.35 33.91 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.096 -0.502 . . . . 62.44 110.888 179.912 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' M' M ' 31' ' ' LEU . . . . . 0.583 HD22 ' HB3' ' A' ' 51' ' ' MET . 19.4 tp -121.92 -34.66 3.32 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.242 -0.435 . . . . 72.21 110.891 179.938 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' M' M ' 32' ' ' LYS . . . . . . . . . . . . . 4.8 pttm -51.31 -39.85 57.79 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.223 -0.444 . . . . 74.0 110.865 179.838 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' M' M ' 33' ' ' HIS . . . . . . . . . . . . . 10.4 t-160 -50.92 -36.74 40.02 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.245 -0.434 . . . . 74.24 110.848 179.91 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' M' M ' 34' ' ' ILE . . . . . . . . . . . . . 50.7 mm -50.16 -39.17 15.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.203 -0.453 . . . . 72.23 111.136 -179.961 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' M' M ' 35' ' ' VAL . . . . . . . . . . . . . 58.3 t -49.31 -39.76 13.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.161 -0.472 . . . . 74.41 111.144 179.836 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' M' M ' 36' ' ' TRP . . . . . . . . . . . . . 23.0 m0 -58.64 -39.36 80.32 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.141 -0.481 . . . . 64.24 110.931 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' M' M ' 37' ' ' ALA . . . . . 0.992 ' HB3' HD13 ' A' ' 39' ' ' LEU . . . -63.84 -18.65 64.36 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.23 -0.441 . . . . 74.24 111.05 179.935 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' M' M ' 38' ' ' SER . . . . . 0.571 ' HB3' HD23 ' A' ' 18' ' ' LEU . 0.7 OUTLIER -72.9 -18.06 61.45 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.229 -0.441 . . . . 75.44 110.853 -179.811 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' M' M ' 39' ' ' ARG . . . . . . . . . . . . . 20.0 ptt180 -57.69 -26.3 61.51 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.17 -0.468 . . . . 74.11 110.873 -179.899 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' M' M ' 40' ' ' GLU . . . . . . . . . . . . . 12.7 tp10 -85.86 -47.94 9.22 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.161 -0.472 . . . . 72.22 110.856 -179.914 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' M' M ' 41' ' ' LEU . . . . . 0.653 HD21 ' OG ' ' A' ' 38' ' ' SER . 13.3 mt -62.78 147.97 48.28 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.163 -0.471 . . . . 73.03 110.866 -179.917 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' M' M ' 42' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -121.23 35.17 4.97 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.178 -0.465 . . . . 72.34 110.856 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' M' M ' 43' ' ' ARG . . . . . . . . . . . . . 53.3 ttp85 . . . . . 0 C--N 1.329 -0.3 0 CA-C-N 116.169 -0.469 . . . . 74.3 110.877 -179.926 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 241' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 262' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 301' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 322' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.457 -0.117 0 CA-C-O 120.824 0.345 . . . . 55.33 111.088 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -69.83 154.97 41.25 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.205 -0.452 . . . . 62.21 110.896 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 20.4 mt-30 56.46 -177.25 0.05 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.204 -0.453 . . . . 73.41 110.907 -179.906 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.604 HD22 ' CD ' ' A' ' 8' ' ' GLN . 8.0 mt -122.67 157.35 32.42 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.168 -0.469 . . . . 75.22 110.933 -179.964 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 70.2 p -121.37 177.85 5.02 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.214 -0.448 . . . . 30.21 111.104 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -54.04 -29.79 45.18 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.219 -0.446 . . . . 64.32 110.895 -179.986 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -65.13 -40.86 95.05 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.148 -0.478 . . . . 64.03 110.887 -179.961 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' GLN . . . . . 0.604 ' CD ' HD22 ' A' ' 4' ' ' LEU . 18.5 tt0 -78.02 -43.15 30.27 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.162 -0.472 . . . . 60.31 110.883 -179.916 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 60.5 mt -65.56 -37.12 79.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.242 -0.435 . . . . 65.44 111.167 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -54.6 -51.83 64.1 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.176 -0.465 . . . . 72.32 111.126 179.784 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -62.34 -49.2 76.52 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.174 -0.466 . . . . 72.5 110.918 -179.959 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.534 ' HB3' HD13 ' A' ' 69' ' ' LEU . 14.2 m-85 -55.85 -45.82 78.34 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.155 -0.475 . . . . 63.53 110.849 -179.941 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 26.6 ttpt -55.46 -25.95 39.47 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.163 -0.472 . . . . 64.14 110.927 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 16.2 tt0 -75.11 -31.07 61.05 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.178 -0.465 . . . . 75.43 110.856 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -70.67 -33.41 70.91 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.14 -0.482 . . . . 61.02 111.096 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 93.9 t80 -75.56 -54.21 7.37 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.232 -0.44 . . . . 65.31 110.886 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 17.4 t -53.23 -29.56 33.21 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.134 -0.485 . . . . 52.43 110.888 -179.827 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.42 HD23 ' CB ' ' M' ' 38' ' ' SER . 16.1 tp -63.58 -41.82 98.33 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.114 -0.494 . . . . 73.13 110.873 -179.954 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.695 ' CD1' HG11 ' A' ' 35' ' ' VAL . 20.1 m-85 -77.55 -30.9 52.95 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.194 -0.457 . . . . 72.04 110.9 179.96 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 13.3 t0 -76.96 98.62 4.99 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.124 -0.489 . . . . 73.42 110.877 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 6.2 tptt -66.47 -49.93 64.99 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.186 -0.461 . . . . 72.25 110.938 179.948 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 24.7 p-10 -81.87 -10.2 59.38 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.237 -0.438 . . . . 75.03 110.852 179.878 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 51.59 44.84 54.33 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.773 -0.727 . . . . 73.31 112.427 -179.97 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 29.4 p-10 -88.32 -15.52 35.48 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.852 0.358 . . . . 74.23 110.897 179.989 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 105.45 -11.63 47.1 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.746 -0.74 . . . . 64.44 112.474 -179.943 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 32.8 p -130.4 130.6 44.55 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.734 0.302 . . . . 54.11 111.159 -179.831 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 24.2 mt -96.34 112.64 28.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.236 -0.438 . . . . 65.42 111.143 179.924 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.54 HG22 HG21 ' A' ' 62' ' ' THR . 21.0 p -95.57 175.52 6.52 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.199 -0.455 . . . . 63.12 111.162 179.932 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.637 HG22 HD12 ' A' ' 52' ' ' ILE . 60.4 p -60.35 -37.2 79.92 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.23 -0.441 . . . . 63.54 111.154 -179.988 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 19.9 mmmt -60.23 -50.11 74.95 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.209 -0.451 . . . . 74.44 110.932 179.857 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.672 ' O ' HG23 ' A' ' 35' ' ' VAL . 51.5 mt-10 -72.11 -32.73 67.25 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.213 -0.448 . . . . 64.2 110.876 179.986 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.535 HD13 ' O ' ' A' ' 32' ' ' LEU . 1.1 tm? -67.83 -44.48 77.12 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.145 -0.479 . . . . 60.42 110.951 179.99 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -71.7 -27.94 70.03 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.721 -0.752 . . . . 43.41 112.532 179.87 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 96.5 m -70.31 -53.64 15.95 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.867 0.365 . . . . 73.31 111.128 -179.869 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.695 HG11 ' CD1' ' A' ' 19' ' ' PHE . 46.8 t -52.53 -51.7 32.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.189 -0.459 . . . . 75.32 111.105 179.937 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' MET . . . . . 0.569 ' HE3' HG13 ' M' ' 34' ' ' ILE . 0.0 OUTLIER -51.89 -39.41 58.99 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.174 -0.466 . . . . 74.22 110.895 179.919 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 21.7 ttt-85 -57.01 -44.67 83.05 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.241 -0.436 . . . . 73.44 110.824 -179.894 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' SER . . . . . 0.621 ' OG ' HD11 ' M' ' 41' ' ' LEU . 1.1 p -67.49 -26.34 66.31 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.217 -0.447 . . . . 64.54 110.835 -179.74 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.966 HD13 ' HB3' ' M' ' 37' ' ' ALA . 48.7 mt -85.64 -21.39 28.44 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.084 -0.507 . . . . 70.22 110.927 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 101.44 31.14 5.64 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.736 -0.745 . . . . 73.32 112.498 179.941 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 10.6 mt-30 -119.56 122.69 42.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.777 0.322 . . . . 44.12 110.94 -179.896 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 22.7 t-20 -109.86 76.84 0.99 Allowed Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 121.627 0.727 . . . . 73.21 110.918 -179.977 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.541 ' HG2' HD21 ' A' ' 48' ' ' LEU . 53.9 Cg_endo -69.76 140.23 42.19 Favored 'Trans proline' 0 C--N 1.342 0.196 0 C-N-CA 122.68 2.253 . . . . 73.12 112.359 179.938 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 29.6 p -72.64 161.63 30.53 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.209 -0.45 . . . . 62.51 111.154 -179.976 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 67.9 tt0 -52.04 -42.9 63.47 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.22 -0.446 . . . . 72.25 110.919 179.978 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.0 -31.54 64.56 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.184 -0.462 . . . . 72.33 111.131 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 55.5 tt0 -66.22 -50.48 63.69 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.157 -0.474 . . . . 74.42 110.872 -179.915 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.541 HD21 ' HG2' ' A' ' 43' ' ' PRO . 40.5 mt -55.17 -47.12 75.62 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.153 -0.476 . . . . 75.14 110.908 -179.954 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -66.42 -29.03 69.09 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.203 -0.453 . . . . 73.51 110.847 179.96 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 37.9 t0 -70.68 -49.57 45.88 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.26 -0.427 . . . . 74.21 110.877 179.945 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 31.8 mtp -59.54 -57.98 10.6 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.174 -0.466 . . . . 75.4 110.874 179.997 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.637 HD12 HG22 ' A' ' 29' ' ' THR . 61.7 mt -53.29 -43.82 51.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.181 -0.463 . . . . 73.52 111.108 179.985 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 71.7 m-20 -64.0 -38.84 92.54 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.145 -0.48 . . . . 65.42 110.906 179.952 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -60.62 -32.08 71.24 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.185 -0.462 . . . . 72.45 110.889 179.988 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 26.5 m -105.31 14.7 7.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.141 -0.481 . . . . 74.11 111.118 -180.0 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 31.0 t0 -90.07 100.19 13.06 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.201 -0.454 . . . . 51.22 110.874 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.23 -45.85 9.73 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.206 -0.452 . . . . 64.23 111.084 179.995 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 16.8 p-10 -81.67 -0.19 41.55 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.246 -0.433 . . . . 73.42 110.87 179.952 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 53.42 56.15 21.15 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.743 -0.742 . . . . 63.42 112.473 -179.978 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 52.0 p-10 -114.49 -15.71 12.01 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.858 0.361 . . . . 73.3 110.907 -179.903 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 91.73 15.59 54.26 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.743 -0.741 . . . . 71.24 112.525 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' THR . . . . . 0.54 HG21 HG22 ' A' ' 28' ' ' THR . 40.0 p -148.01 163.75 35.9 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.776 0.322 . . . . 74.25 111.139 -179.843 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 24.2 mt -99.9 109.5 24.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.2 -0.454 . . . . 75.23 111.141 179.868 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 4.6 t0 -75.42 -172.97 1.94 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.155 -0.475 . . . . 71.05 110.831 179.863 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.53 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 2.5 t80 -65.68 -58.42 11.62 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 121.618 0.723 . . . . 74.24 110.891 -179.886 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 66' ' ' PRO . . . . . 0.53 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 54.1 Cg_endo -69.74 -25.5 28.65 Favored 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.667 2.245 . . . . 52.01 112.376 179.961 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 17.4 mt-10 -61.61 -43.57 98.62 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.222 -0.444 . . . . 63.33 110.871 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 21.7 t80 -71.21 -36.21 71.8 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.172 -0.467 . . . . 72.22 110.921 -179.958 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.534 HD13 ' HB3' ' A' ' 12' ' ' PHE . 21.4 tp -62.56 -53.79 49.46 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.133 -0.485 . . . . 74.24 110.901 179.989 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 9.9 t -60.48 -30.96 70.02 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.146 -0.479 . . . . 60.53 111.116 179.951 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 7.9 tmm? -61.45 -46.76 88.74 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.233 -0.439 . . . . 74.41 110.902 179.914 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -76.07 -48.57 20.32 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.216 -0.447 . . . . 75.1 110.886 179.948 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -56.26 -28.53 58.94 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.267 -0.424 . . . . 53.51 111.107 179.923 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 16.7 ttt85 -64.87 -19.27 65.8 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.189 -0.46 . . . . 72.31 110.872 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 48.2 pttt -52.52 -29.4 25.0 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.254 -0.43 . . . . 61.12 110.9 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 5.4 ptt? -115.92 19.23 15.22 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.197 -0.456 . . . . 74.12 110.884 179.864 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 1.9 tmtm? -99.21 -68.77 0.79 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.258 -0.428 . . . . 71.23 110.861 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -173.02 -176.75 1.45 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.254 -0.43 . . . . 63.23 110.892 179.928 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 1.9 m 63.67 106.61 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.212 -0.449 . . . . 70.42 111.168 -179.868 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -168.61 -38.79 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.218 -0.446 . . . . 70.1 110.892 179.902 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 14.9 t -53.14 -34.75 58.14 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.151 -0.477 . . . . 74.24 110.873 -179.78 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.42 ' HA ' HD12 ' A' ' 85' ' ' ILE . 20.2 tp10 -56.49 -26.64 54.95 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.097 -0.501 . . . . 64.33 110.864 -179.946 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 5.4 tm-20 -75.84 -47.24 26.37 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.169 -0.468 . . . . 61.33 110.913 -179.919 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 5.1 mp0 -54.58 -40.2 68.57 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.144 -0.48 . . . . 75.23 110.867 -179.903 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.422 HG21 HG22 ' A' ' 142' ' ' VAL . 67.3 mt -57.47 -36.1 52.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.142 -0.481 . . . . 75.53 111.115 -179.997 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.06 -32.03 71.22 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.195 -0.457 . . . . 74.43 110.843 179.991 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.706 ' O ' HG23 ' A' ' 91' ' ' VAL . 8.3 tm-20 -75.67 -51.67 12.24 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.177 -0.465 . . . . 71.13 110.85 -179.881 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -54.73 -50.96 67.11 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.163 -0.472 . . . . 42.51 111.069 179.957 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 22.2 t80 -53.47 -44.49 69.01 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.207 -0.451 . . . . 75.53 110.839 -179.862 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 1.6 tmm_? -66.64 -46.04 77.05 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.176 -0.465 . . . . 72.24 110.889 -179.938 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' VAL . . . . . 0.706 HG23 ' O ' ' A' ' 87' ' ' GLU . 91.6 t -54.42 -51.02 53.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.18 -0.463 . . . . 75.52 111.11 -179.994 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.575 ' CE1' HG11 ' A' ' 108' ' ' VAL . 19.6 m-85 -66.13 -27.1 67.78 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.194 -0.457 . . . . 73.14 110.866 -179.978 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 31.4 t0 -69.67 95.21 0.85 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.13 -0.487 . . . . 60.44 110.855 179.989 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 5.7 mptp? -78.42 -52.59 8.33 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.198 -0.455 . . . . 73.34 110.865 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 44.2 p30 -72.63 -9.04 58.12 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.235 -0.438 . . . . 64.04 110.902 179.867 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 59.68 27.05 63.35 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.715 -0.755 . . . . 75.34 112.509 -179.951 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 40.0 p-10 -82.06 -16.19 50.98 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.847 0.356 . . . . 73.33 110.882 -179.928 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 84.79 18.67 61.1 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.683 -0.77 . . . . 55.23 112.517 179.978 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 20.6 m-85 -140.66 135.26 31.49 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.856 0.36 . . . . 73.42 110.936 -179.787 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 66.2 mt -102.27 126.83 56.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.125 -0.489 . . . . 75.5 111.164 179.908 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 28.7 p -111.66 -174.59 2.5 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.198 -0.456 . . . . 63.42 110.844 -179.891 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 102' ' ' ALA . . . . . 0.601 ' O ' HG11 ' A' ' 121' ' ' VAL . . . -71.2 -34.5 70.91 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.113 -0.494 . . . . 64.11 111.116 179.915 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -71.98 -44.83 62.88 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.209 -0.45 . . . . 75.32 111.089 179.935 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -69.09 -50.13 51.01 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.229 -0.441 . . . . 73.03 110.914 -179.934 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 42.5 tp -52.94 -33.3 50.22 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.183 -0.462 . . . . 74.54 110.94 179.991 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 106' ' ' ARG . . . . . 0.644 ' HB2' HG21 ' A' ' 121' ' ' VAL . 58.4 ttp85 -73.74 -36.95 65.22 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.202 -0.453 . . . . 61.24 110.896 179.943 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 2.0 t60 -54.34 -38.11 65.66 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.123 -0.49 . . . . 75.13 110.892 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.575 HG11 ' CE1' ' A' ' 92' ' ' PHE . 23.3 t -69.86 -48.14 65.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.162 -0.472 . . . . 64.23 111.137 179.961 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 109' ' ' MET . . . . . 0.464 ' HB3' HD12 ' A' ' 116' ' ' LEU . 2.4 mmt -59.72 -38.27 81.22 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.196 -0.456 . . . . 73.51 110.902 179.906 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 8.0 m -52.25 -43.03 64.13 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.218 -0.446 . . . . 65.33 111.176 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -68.34 -28.91 67.56 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.203 -0.453 . . . . 65.25 110.874 179.978 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.433 ' O ' HD23 ' A' ' 112' ' ' LEU . 1.1 tt -70.87 -26.12 63.11 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.207 -0.452 . . . . 63.54 110.893 179.96 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 99.81 30.57 6.38 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.712 -0.756 . . . . 52.24 112.476 179.921 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -115.87 113.39 23.28 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.892 0.377 . . . . 75.52 110.884 -179.856 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 14.9 pttp -64.19 116.24 5.79 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.187 -0.46 . . . . 73.55 110.91 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.464 HD12 ' HB3' ' A' ' 109' ' ' MET . 14.2 mt -145.25 133.36 21.5 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.231 -0.441 . . . . 75.31 110.893 179.964 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 117' ' ' THR . . . . . 0.653 ' O ' HG23 ' A' ' 121' ' ' VAL . 27.8 p -107.42 -177.13 3.26 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.167 -0.469 . . . . 72.4 111.153 179.994 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -58.91 -37.78 77.43 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.264 -0.425 . . . . 75.03 110.826 179.907 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 61.5 tt0 -73.91 -33.92 64.18 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.181 -0.463 . . . . 63.53 110.86 -179.895 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 120' ' ' GLU . . . . . 0.41 ' HG2' HD22 ' A' ' 116' ' ' LEU . 10.4 tt0 -74.06 -37.21 64.32 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.172 -0.467 . . . . 73.0 110.874 -179.901 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.653 HG23 ' O ' ' A' ' 117' ' ' THR . 61.0 t -74.29 -31.0 27.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.137 -0.483 . . . . 74.04 111.106 179.991 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -52.01 -45.32 64.5 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.172 -0.467 . . . . 71.22 110.864 179.903 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 21.5 tp10 -56.07 -29.69 60.9 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.186 -0.461 . . . . 52.13 110.887 -179.893 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 124' ' ' MET . . . . . 0.401 ' HE1' HD11 ' M' ' 19' ' ' ILE . 14.6 mtp -75.06 -57.39 3.93 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.161 -0.472 . . . . 70.45 110.823 179.985 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.444 HG13 ' HB2' ' A' ' 102' ' ' ALA . 35.8 mm -53.88 -35.65 28.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.233 -0.439 . . . . 71.41 111.151 -179.992 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 22.1 ttp85 -63.38 -31.8 73.05 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.125 -0.489 . . . . 70.32 110.861 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 20.0 tp10 -75.01 -52.41 11.15 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.21 -0.45 . . . . 70.55 110.861 -179.922 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.674 ' HB3' HG22 ' A' ' 136' ' ' VAL . . . -64.96 -34.41 78.37 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.175 -0.466 . . . . 63.11 111.106 179.952 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 49.2 t0 -68.42 86.67 0.29 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.208 -0.451 . . . . 61.13 110.888 179.96 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 58.0 mt -79.8 -46.34 22.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.218 -0.446 . . . . 63.24 111.139 179.997 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 21.2 p30 -72.66 -8.74 56.83 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.225 -0.443 . . . . 72.35 110.87 179.837 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 62.79 42.97 99.59 Favored Glycine 0 N--CA 1.452 -0.245 0 C-N-CA 120.738 -0.744 . . . . 40.53 112.456 -179.912 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 34.6 p-10 -88.07 -15.89 35.05 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.809 0.338 . . . . 71.44 110.879 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 104.11 2.25 45.11 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.709 -0.758 . . . . 74.3 112.514 -179.932 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 4.0 tt0 -149.14 172.24 15.13 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.852 0.358 . . . . 72.02 110.903 -179.876 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 136' ' ' VAL . . . . . 0.674 HG22 ' HB3' ' A' ' 128' ' ' ALA . 92.9 t -106.75 109.87 29.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.213 -0.449 . . . . 55.41 111.093 179.951 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 20.4 p30 -90.97 164.86 13.84 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.15 -0.477 . . . . 72.41 110.903 179.921 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 138' ' ' TYR . . . . . 0.603 ' O ' HG23 ' A' ' 142' ' ' VAL . 70.1 t80 -52.05 -46.72 65.19 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.135 -0.484 . . . . 72.52 110.922 -179.932 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 11.5 tm-20 -51.92 -39.98 60.02 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.148 -0.478 . . . . 70.21 110.873 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 22.5 mt-10 -78.41 -41.69 32.36 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.153 -0.476 . . . . 75.41 110.929 -179.923 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 64.6 t80 -59.29 -35.8 74.41 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.128 -0.487 . . . . 75.53 110.899 -179.957 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 142' ' ' VAL . . . . . 0.603 HG23 ' O ' ' A' ' 138' ' ' TYR . 91.4 t -71.28 -37.87 67.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.153 -0.476 . . . . 74.34 111.137 179.953 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 39.9 tp60 -73.94 -31.23 62.95 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.199 -0.455 . . . . 73.44 110.922 179.986 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 9.0 tpt -74.11 -56.54 4.79 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.2 -0.454 . . . . 73.14 110.877 179.948 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 12.3 ttm -61.48 -26.09 67.67 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.286 -0.415 . . . . 63.44 110.879 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 2.5 m -109.78 21.31 17.06 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.229 -0.442 . . . . 70.44 111.107 -179.87 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -51.76 115.59 1.72 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.171 -0.468 . . . . 73.14 111.103 179.823 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.289 0 CA-C-N 116.234 -0.439 . . . . 64.03 110.928 179.939 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' M' M ' 8' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.231 0.117 0 CA-C-O 120.757 0.313 . . . . 75.1 110.913 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' M' M ' 9' ' ' SER . . . . . . . . . . . . . 1.8 t 62.02 48.02 5.43 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.194 -0.457 . . . . 50.33 110.844 -179.956 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' M' M ' 10' ' ' GLY . . . . . . . . . . . . . . . -90.2 166.38 32.13 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.797 -0.716 . . . . 55.31 112.499 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' M' M ' 11' ' ' GLY . . . . . . . . . . . . . . . -69.9 173.88 37.53 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.72 -0.752 . . . . 65.41 112.491 -179.879 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' M' M ' 12' ' ' GLU . . . . . . . . . . . . . 19.9 mt-10 -112.24 -58.2 2.17 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.884 0.373 . . . . 71.52 110.932 -179.913 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' M' M ' 13' ' ' LEU . . . . . 0.752 HD22 ' HG2' ' M' ' 15' ' ' LYS . 2.5 tt -87.97 129.21 35.32 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.13 -0.487 . . . . 62.53 110.901 -179.958 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' M' M ' 14' ' ' ASP . . . . . 0.615 ' N ' HD23 ' M' ' 13' ' ' LEU . 41.4 t0 -78.64 59.27 2.44 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.222 -0.445 . . . . 61.31 110.856 179.855 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' M' M ' 15' ' ' LYS . . . . . 0.752 ' HG2' HD22 ' M' ' 13' ' ' LEU . 18.9 mttp -69.43 -42.31 75.16 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.207 -0.451 . . . . 54.52 110.871 179.982 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' M' M ' 16' ' ' TRP . . . . . 0.723 ' CE3' HD12 ' M' ' 19' ' ' ILE . 10.6 m95 -51.76 -46.91 64.26 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.247 -0.433 . . . . 75.51 110.944 179.904 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' M' M ' 17' ' ' GLU . . . . . . . . . . . . . 3.1 tm-20 -55.36 -27.1 45.09 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.189 -0.46 . . . . 75.34 110.889 -179.965 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' M' M ' 18' ' ' LYS . . . . . . . . . . . . . 8.7 ttmm -75.61 -28.93 59.05 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.127 -0.488 . . . . 74.21 110.891 179.995 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' M' M ' 19' ' ' ILE . . . . . 0.723 HD12 ' CE3' ' M' ' 16' ' ' TRP . 54.5 mt -78.95 -24.86 13.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.207 -0.451 . . . . 71.5 111.166 179.832 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' M' M ' 20' ' ' ARG . . . . . . . . . . . . . 48.7 ttp180 -52.01 -30.14 23.96 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.154 -0.475 . . . . 70.2 110.851 179.996 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' M' M ' 21' ' ' LEU . . . . . . . . . . . . . 6.9 mt 57.68 -175.98 0.07 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.194 -0.457 . . . . 71.01 110.908 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' M' M ' 22' ' ' ARG . . . . . . . . . . . . . 6.7 ptt180 -157.75 65.88 3.44 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 121.556 0.693 . . . . 75.2 110.875 179.946 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' M' M ' 23' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.77 -40.3 5.47 Favored 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.663 2.242 . . . . 72.31 112.351 -179.976 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' M' M ' 24' ' ' GLY . . . . . . . . . . . . . . . 84.47 50.08 4.39 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.76 -0.733 . . . . 42.22 112.517 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' M' M ' 25' ' ' GLY . . . . . . . . . . . . . . . -52.23 171.43 0.4 Allowed Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.733 -0.746 . . . . 41.31 112.539 -179.907 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' M' M ' 26' ' ' LYS . . . . . . . . . . . . . 8.5 pttm -172.61 35.14 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.889 0.376 . . . . 72.34 110.888 179.996 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' M' M ' 27' ' ' LYS . . . . . . . . . . . . . 30.7 tttm -175.02 112.82 0.14 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.233 -0.44 . . . . 74.42 110.924 179.869 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' M' M ' 28' ' ' GLN . . . . . . . . . . . . . 3.5 pp0? -108.13 -33.54 7.13 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.232 -0.44 . . . . 75.31 110.938 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' M' M ' 29' ' ' TYR . . . . . . . . . . . . . 9.3 m-85 -62.36 120.98 12.07 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.156 -0.475 . . . . 64.25 110.922 -179.865 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' M' M ' 30' ' ' LYS . . . . . . . . . . . . . 2.1 ptmt -95.87 27.24 3.63 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.13 -0.486 . . . . 54.42 110.864 179.921 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' M' M ' 31' ' ' LEU . . . . . 0.536 HD12 ' O ' ' M' ' 31' ' ' LEU . 10.0 tp -118.87 -31.38 4.8 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.233 -0.439 . . . . 63.31 110.945 179.937 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' M' M ' 32' ' ' LYS . . . . . 0.401 ' O ' HG23 ' M' ' 35' ' ' VAL . 5.4 mtpm? -49.89 -44.61 50.08 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.155 -0.475 . . . . 73.43 110.89 179.821 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' M' M ' 33' ' ' HIS . . . . . . . . . . . . . 3.6 t60 -50.71 -37.31 40.72 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.272 -0.422 . . . . 71.3 110.839 179.909 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' M' M ' 34' ' ' ILE . . . . . 0.569 HG13 ' HE3' ' A' ' 36' ' ' MET . 49.3 mm -50.27 -39.65 16.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.197 -0.456 . . . . 65.52 111.12 179.977 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' M' M ' 35' ' ' VAL . . . . . 0.401 HG23 ' O ' ' M' ' 32' ' ' LYS . 40.1 t -49.31 -39.95 13.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.159 -0.473 . . . . 73.41 111.123 179.876 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' M' M ' 36' ' ' TRP . . . . . . . . . . . . . 24.8 m0 -58.78 -39.45 81.07 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.173 -0.467 . . . . 75.23 110.96 179.964 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' M' M ' 37' ' ' ALA . . . . . 0.966 ' HB3' HD13 ' A' ' 39' ' ' LEU . . . -64.1 -18.62 64.57 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.257 -0.429 . . . . 74.3 111.084 179.851 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' M' M ' 38' ' ' SER . . . . . 0.42 ' CB ' HD23 ' A' ' 18' ' ' LEU . 0.7 OUTLIER -73.29 -17.92 61.26 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.227 -0.442 . . . . 74.15 110.877 -179.782 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' M' M ' 39' ' ' ARG . . . . . . . . . . . . . 22.5 mmm180 -62.76 -25.18 68.08 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.149 -0.478 . . . . 71.1 110.837 -179.94 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' M' M ' 40' ' ' GLU . . . . . . . . . . . . . 7.0 mp0 -77.21 -48.03 18.66 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.211 -0.45 . . . . 73.4 110.898 -179.917 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' M' M ' 41' ' ' LEU . . . . . 0.621 HD11 ' OG ' ' A' ' 38' ' ' SER . 18.0 mt -54.77 133.95 47.55 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.103 -0.499 . . . . 60.4 110.904 -179.932 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' M' M ' 42' ' ' GLU . . . . . . . . . . . . . 13.4 tp10 -105.28 138.57 41.28 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.166 -0.47 . . . . 64.45 110.868 179.989 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' M' M ' 43' ' ' ARG . . . . . . . . . . . . . 47.7 mtp180 . . . . . 0 C--N 1.329 -0.299 0 CA-C-N 116.164 -0.471 . . . . 71.54 110.855 -179.888 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 241' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 262' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 301' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 322' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.457 -0.086 0 CA-C-O 120.813 0.34 . . . . 71.33 111.142 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 21.9 t0 -84.96 142.56 29.56 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.202 -0.453 . . . . 73.43 110.876 179.958 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 64.1 mt-30 -154.66 154.26 32.65 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.24 -0.436 . . . . 74.15 110.872 -179.934 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.435 HD22 ' CD ' ' A' ' 8' ' ' GLN . 19.4 mt -105.15 151.57 23.87 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.166 -0.47 . . . . 64.33 110.944 179.97 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 57.8 p -119.12 173.12 7.1 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.172 -0.467 . . . . 74.43 111.164 179.993 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 11.1 tt0 -52.89 -29.29 27.49 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.263 -0.426 . . . . 62.41 110.853 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 33.1 tp10 -67.16 -41.6 85.71 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.174 -0.467 . . . . 71.32 110.895 -179.929 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' GLN . . . . . 0.435 ' CD ' HD22 ' A' ' 4' ' ' LEU . 19.3 tt0 -77.73 -39.25 45.07 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.129 -0.487 . . . . 74.21 110.864 -179.886 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 64.2 mt -69.84 -37.23 72.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.186 -0.461 . . . . 74.25 111.139 179.951 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -52.16 -50.81 61.06 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.203 -0.453 . . . . 43.52 111.097 179.831 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 17.5 mt-10 -57.02 -52.22 66.14 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.187 -0.46 . . . . 65.03 110.847 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.526 ' CB ' HD13 ' A' ' 69' ' ' LEU . 45.7 m-85 -58.02 -42.36 85.09 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.206 -0.452 . . . . 75.13 110.879 -179.907 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 21.7 ttpp -51.88 -41.26 61.77 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.114 -0.494 . . . . 74.14 110.932 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 56.5 tt0 -62.81 -32.87 74.15 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.261 -0.427 . . . . 74.51 110.829 180.0 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -68.91 -37.63 79.07 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.15 -0.477 . . . . 74.31 111.062 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 89.8 t80 -69.96 -53.22 18.77 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.257 -0.429 . . . . 75.31 110.912 -179.911 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 1.7 t -52.04 -35.79 48.3 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.153 -0.476 . . . . 71.23 110.855 -179.824 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 18.7 tp -59.81 -45.71 91.48 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.129 -0.487 . . . . 73.54 110.931 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.648 ' CD1' HG11 ' A' ' 35' ' ' VAL . 20.8 m-85 -73.07 -34.08 66.02 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.193 -0.458 . . . . 74.02 110.88 179.911 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 9.6 t0 -76.37 98.43 4.53 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.175 -0.466 . . . . 72.42 110.897 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 3.0 ttmp? -71.38 -55.73 7.39 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.188 -0.46 . . . . 72.23 110.903 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 22.3 p-10 -74.82 -10.04 59.12 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.227 -0.442 . . . . 74.41 110.863 179.867 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 52.25 44.26 57.67 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.732 -0.747 . . . . 72.04 112.486 -179.934 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 35.7 p-10 -89.58 -15.8 32.05 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.88 0.371 . . . . 70.41 110.893 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 103.92 -11.63 52.67 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.716 -0.754 . . . . 71.41 112.501 -179.906 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 19.8 p -128.01 133.26 49.13 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.736 0.303 . . . . 70.33 111.144 -179.866 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 24.5 mt -103.94 111.54 33.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.22 -0.445 . . . . 64.44 111.119 179.934 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.697 HG22 HG21 ' A' ' 62' ' ' THR . 20.3 p -94.81 -179.73 4.95 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.158 -0.474 . . . . 61.2 111.138 179.991 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 65.3 p -61.05 -32.04 71.67 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.185 -0.461 . . . . 75.35 111.164 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 24.1 tptm -68.31 -50.11 55.76 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.18 -0.463 . . . . 70.4 110.921 179.867 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.481 ' O ' HG23 ' A' ' 35' ' ' VAL . 35.9 mt-10 -70.33 -32.7 70.55 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.208 -0.451 . . . . 44.31 110.907 179.937 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.845 HD12 HD22 ' A' ' 48' ' ' LEU . 0.9 OUTLIER -74.14 -41.2 61.93 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.145 -0.48 . . . . 71.44 110.917 -179.963 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -71.72 -41.01 57.57 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.738 -0.744 . . . . 73.51 112.478 179.902 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 97.3 m -56.69 -56.43 21.47 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.82 0.343 . . . . 73.55 111.079 -179.839 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.648 HG11 ' CD1' ' A' ' 19' ' ' PHE . 91.9 t -52.01 -44.78 39.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.227 -0.442 . . . . 74.35 111.117 179.953 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 6.1 mmm -56.38 -34.46 66.7 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.173 -0.467 . . . . 54.02 110.913 179.874 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 35.9 ttp85 -57.53 -55.26 37.12 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.195 -0.457 . . . . 72.11 110.899 -179.912 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' SER . . . . . 0.589 ' OG ' HD21 ' M' ' 41' ' ' LEU . 3.4 t -59.09 -27.0 65.15 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.205 -0.452 . . . . 71.03 110.842 -179.825 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.957 HD13 ' HB3' ' M' ' 37' ' ' ALA . 55.7 mt -78.98 -16.46 56.9 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.176 -0.466 . . . . 64.14 110.957 179.986 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 101.55 26.38 7.69 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.751 -0.738 . . . . 41.21 112.461 179.881 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 17.3 mt-30 -133.38 123.06 24.7 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.801 0.334 . . . . 70.23 110.92 -179.878 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 2.0 t30 -109.82 76.9 0.99 Allowed Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.6 0.714 . . . . 71.15 110.9 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.656 ' CG ' HD21 ' A' ' 48' ' ' LEU . 53.8 Cg_endo -69.79 161.81 44.51 Favored 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.651 2.234 . . . . 75.33 112.344 179.94 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 34.1 p -100.14 168.74 9.62 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.195 -0.457 . . . . 74.43 111.12 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 4.4 mp0 -54.43 -51.1 66.0 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.171 -0.468 . . . . 74.4 110.861 -179.972 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -67.28 -31.5 71.87 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.174 -0.467 . . . . 71.43 111.143 179.931 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -65.35 -46.77 78.87 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.199 -0.455 . . . . 73.13 110.866 -179.941 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.845 HD22 HD12 ' A' ' 32' ' ' LEU . 18.3 mt -67.78 -51.9 43.48 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.188 -0.46 . . . . 71.42 110.922 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 5.7 tp-100 -52.91 -28.49 23.59 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.217 -0.447 . . . . 63.13 110.962 179.901 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -64.42 -49.83 70.0 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.159 -0.473 . . . . 63.3 110.888 179.973 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 6.1 ptp -76.35 -35.71 58.57 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.175 -0.466 . . . . 62.23 110.882 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 81.8 mt -66.09 -38.35 81.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.205 -0.452 . . . . 70.14 111.138 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 28.0 m-20 -63.59 -43.23 97.55 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.125 -0.489 . . . . 74.35 110.836 179.998 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -57.9 -43.54 86.23 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.204 -0.453 . . . . 73.14 110.856 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 36.0 m -81.56 -13.14 12.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.197 -0.456 . . . . 74.43 111.124 179.977 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 38.2 t0 -66.89 97.61 0.49 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.198 -0.456 . . . . 73.44 110.82 179.973 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.19 -44.31 10.98 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.156 -0.475 . . . . 65.33 111.132 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 9.3 p-10 -81.74 -0.17 41.76 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.207 -0.451 . . . . 74.22 110.837 179.998 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 54.51 57.37 17.7 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.716 -0.754 . . . . 70.4 112.507 -179.942 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 52.1 p-10 -114.53 -15.81 11.97 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.859 0.361 . . . . 63.43 110.852 -179.848 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 93.82 15.89 47.39 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.744 -0.741 . . . . 63.15 112.453 179.963 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' THR . . . . . 0.697 HG21 HG22 ' A' ' 28' ' ' THR . 44.6 p -148.84 175.34 11.34 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.763 0.316 . . . . 73.12 111.13 -179.857 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 19.2 mt -107.84 109.78 29.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.197 -0.456 . . . . 74.01 111.161 179.897 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.4 t0 -75.28 -172.93 1.88 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.181 -0.463 . . . . 75.41 110.818 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.531 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 2.5 t80 -65.29 -58.28 12.68 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-O 121.635 0.731 . . . . 75.14 110.888 -179.933 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' PRO . . . . . 0.531 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 53.6 Cg_endo -69.76 -26.42 27.6 Favored 'Trans proline' 0 C--N 1.341 0.146 0 C-N-CA 122.649 2.233 . . . . 74.43 112.364 -179.994 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 20.3 mt-10 -62.07 -40.57 96.26 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.199 -0.455 . . . . 75.11 110.891 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 17.2 t80 -74.36 -35.86 63.57 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.158 -0.474 . . . . 75.1 110.903 -179.925 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.526 HD13 ' CB ' ' A' ' 12' ' ' PHE . 33.6 tp -69.92 -53.9 15.79 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.098 -0.501 . . . . 64.34 110.916 -179.958 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 14.0 t -53.29 -30.69 40.1 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.175 -0.466 . . . . 73.25 111.155 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 36.2 ttp -58.79 -50.62 73.27 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.222 -0.444 . . . . 71.1 110.856 179.956 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 1.4 mmt -66.08 -48.81 69.74 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.263 -0.426 . . . . 72.23 110.891 179.932 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -55.31 -28.65 55.06 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.262 -0.426 . . . . 72.41 111.055 179.904 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 23.3 ttm180 -64.71 -20.06 66.11 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.219 -0.446 . . . . 72.01 110.875 -179.866 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 8.5 ptmm? -51.66 -30.29 21.17 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.165 -0.471 . . . . 63.32 110.885 179.963 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 1.3 tpt -52.0 -35.67 47.37 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.27 -0.423 . . . . 72.3 110.872 179.9 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -175.92 139.42 0.39 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.183 -0.462 . . . . 75.21 110.898 179.959 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 78' ' ' ASP . . . . . 0.51 ' O ' HG23 ' A' ' 79' ' ' THR . 0.3 OUTLIER -168.26 -74.81 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.202 -0.454 . . . . 73.01 110.882 179.88 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 79' ' ' THR . . . . . 0.51 HG23 ' O ' ' A' ' 78' ' ' ASP . 0.6 OUTLIER -164.21 176.69 8.98 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.188 -0.46 . . . . 62.02 111.149 -179.968 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -165.65 -74.41 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.192 -0.458 . . . . 64.42 110.859 179.936 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 89.0 p -77.26 -51.54 10.73 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.167 -0.469 . . . . 74.13 110.858 -179.724 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -55.04 -26.74 39.43 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.09 -0.505 . . . . 74.44 110.859 -179.932 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 12.9 tt0 -70.35 -52.8 19.99 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.188 -0.46 . . . . 62.14 110.869 -179.92 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 24.6 tp10 -69.39 -48.08 62.24 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.158 -0.473 . . . . 62.11 110.925 -179.964 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.834 HG21 HG22 ' A' ' 142' ' ' VAL . 56.3 mt -55.26 -46.83 78.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.127 -0.488 . . . . 75.42 111.08 -179.983 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 44.8 ttp180 -53.99 -33.49 57.2 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.188 -0.46 . . . . 72.25 110.843 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.716 ' O ' HG23 ' A' ' 91' ' ' VAL . 28.2 tt0 -76.63 -57.45 3.85 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.215 -0.448 . . . . 73.31 110.858 -179.879 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -53.53 -48.54 68.96 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.15 -0.477 . . . . 61.14 111.113 179.938 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 7.0 t80 -52.02 -51.26 58.57 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.21 -0.45 . . . . 71.12 110.855 -179.942 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 2.1 tmt_? -62.52 -46.95 86.05 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.166 -0.47 . . . . 72.3 110.891 -179.892 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' VAL . . . . . 0.716 HG23 ' O ' ' A' ' 87' ' ' GLU . 87.8 t -51.88 -47.91 40.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.189 -0.46 . . . . 71.45 111.143 179.941 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 18.6 m-85 -73.57 -26.48 60.85 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.148 -0.478 . . . . 64.41 110.889 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 31.6 t0 -69.77 95.2 0.87 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.118 -0.492 . . . . 73.5 110.854 179.985 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -78.65 -52.51 8.33 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.188 -0.46 . . . . 72.24 110.89 -179.998 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 53.6 p30 -72.66 -9.16 58.28 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.213 -0.448 . . . . 53.43 110.862 179.91 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 59.87 28.0 65.24 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.711 -0.757 . . . . 53.25 112.492 -179.955 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 46.0 p-10 -82.08 -16.14 51.06 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.871 0.367 . . . . 64.04 110.894 -179.859 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 88.1 18.66 55.39 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.743 -0.742 . . . . 25.54 112.507 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 12.9 m-85 -138.89 151.98 47.39 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.862 0.363 . . . . 74.41 110.911 -179.782 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 70.8 mt -115.73 122.34 69.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.154 -0.476 . . . . 65.44 111.167 179.907 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 53.4 p -114.81 -172.58 2.15 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.191 -0.459 . . . . 72.23 110.871 -179.877 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -74.75 -39.77 61.64 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.179 -0.464 . . . . 74.22 111.154 179.872 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -62.72 -39.98 95.77 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.188 -0.46 . . . . 55.2 111.09 179.906 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 21.6 mt-10 -76.95 -46.75 23.05 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.217 -0.447 . . . . 75.32 110.863 -179.89 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 29.7 tp -53.16 -43.97 67.46 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.136 -0.484 . . . . 74.4 110.926 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 106' ' ' ARG . . . . . 0.45 ' O ' HG23 ' A' ' 110' ' ' THR . 21.7 ttt-85 -51.99 -39.13 58.92 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.175 -0.466 . . . . 70.31 110.868 179.933 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 16.3 t60 -63.3 -35.53 80.67 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.192 -0.458 . . . . 70.12 110.847 -179.965 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 90.7 t -70.04 -52.29 32.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.218 -0.446 . . . . 50.33 111.143 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 109' ' ' MET . . . . . 0.461 ' HB3' HD12 ' A' ' 116' ' ' LEU . 1.6 mmt -61.46 -44.68 96.67 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.172 -0.467 . . . . 74.11 110.849 179.906 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 110' ' ' THR . . . . . 0.45 HG23 ' O ' ' A' ' 106' ' ' ARG . 12.9 p -53.01 -32.78 48.5 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.249 -0.432 . . . . 72.44 111.17 -179.871 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 8.9 t30 -74.62 -31.01 61.86 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.209 -0.451 . . . . 72.04 110.868 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.424 ' O ' HD23 ' A' ' 112' ' ' LEU . 1.1 tt -70.7 -26.07 63.25 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.193 -0.458 . . . . 72.5 110.925 179.966 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 100.12 23.28 10.69 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.758 -0.734 . . . . 61.21 112.468 179.928 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 54.7 tp10 -104.3 115.58 30.63 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.894 0.378 . . . . 75.33 110.88 -179.861 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 115' ' ' LYS . . . . . 0.464 ' O ' HD23 ' A' ' 116' ' ' LEU . 14.0 pttp -64.82 117.77 8.01 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.156 -0.475 . . . . 75.03 110.884 179.968 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.464 HD23 ' O ' ' A' ' 115' ' ' LYS . 17.2 mt -146.75 130.66 17.16 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.196 -0.456 . . . . 73.43 110.912 179.901 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 117' ' ' THR . . . . . 0.475 ' O ' HG23 ' A' ' 121' ' ' VAL . 32.6 p -92.13 170.9 9.46 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.162 -0.472 . . . . 71.12 111.193 179.964 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 60.3 m-20 -53.24 -43.37 67.28 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.262 -0.426 . . . . 74.0 110.909 179.867 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 16.5 tp10 -65.55 -35.02 79.62 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.187 -0.461 . . . . 73.31 110.837 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 120' ' ' GLU . . . . . 0.422 ' HG2' HD22 ' A' ' 116' ' ' LEU . 2.2 tp10 -65.97 -40.72 91.5 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.178 -0.464 . . . . 71.44 110.859 -179.875 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.475 HG23 ' O ' ' A' ' 117' ' ' THR . 30.6 t -61.29 -38.94 80.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.147 -0.479 . . . . 74.02 111.164 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -52.02 -48.92 64.27 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.138 -0.483 . . . . 73.4 110.836 179.946 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -56.22 -29.3 60.78 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.203 -0.453 . . . . 74.14 110.859 -179.905 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 124' ' ' MET . . . . . 0.542 ' HE1' HD11 ' M' ' 19' ' ' ILE . 0.1 OUTLIER -73.37 -59.62 2.62 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.191 -0.459 . . . . 64.44 110.831 179.997 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.44 HG23 HG23 ' A' ' 136' ' ' VAL . 33.0 mm -54.06 -35.81 29.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.238 -0.437 . . . . 55.24 111.134 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 69.2 ttt180 -63.44 -31.77 73.03 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.163 -0.471 . . . . 73.23 110.921 179.906 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 6.7 tp10 -71.43 -44.34 65.04 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.21 -0.45 . . . . 73.2 110.934 -179.959 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.714 ' HB3' HG22 ' A' ' 136' ' ' VAL . . . -76.06 -26.58 56.68 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.113 -0.494 . . . . 70.52 111.085 179.94 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 43.1 t0 -68.04 87.52 0.26 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.189 -0.46 . . . . 74.42 110.88 179.991 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 130' ' ' ILE . . . . . 0.42 HD12 ' HG2' ' A' ' 140' ' ' GLU . 60.8 mt -79.91 -49.33 19.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.175 -0.466 . . . . 70.51 111.126 -179.978 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 18.8 p30 -72.91 -8.7 56.82 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.167 -0.47 . . . . 72.2 110.841 179.842 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 63.9 44.67 95.73 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.751 -0.738 . . . . 71.12 112.521 -179.907 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 35.8 p-10 -91.18 -15.88 28.6 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.884 0.373 . . . . 65.12 110.862 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 104.19 2.33 44.86 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.758 -0.734 . . . . 72.12 112.457 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 2.7 tt0 -149.19 172.2 15.22 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.775 0.321 . . . . 60.41 110.935 -179.9 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 136' ' ' VAL . . . . . 0.714 HG22 ' HB3' ' A' ' 128' ' ' ALA . 61.6 t -105.63 109.74 28.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.176 -0.466 . . . . 41.42 111.142 179.938 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 23.1 p30 -89.09 165.46 14.49 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.167 -0.47 . . . . 71.33 110.934 179.948 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 138' ' ' TYR . . . . . 0.62 ' O ' HG23 ' A' ' 142' ' ' VAL . 87.1 t80 -52.05 -47.2 65.21 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.158 -0.474 . . . . 72.31 110.921 -179.898 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -52.01 -37.98 55.21 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.144 -0.48 . . . . 64.34 110.881 179.998 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 140' ' ' GLU . . . . . 0.42 ' HG2' HD12 ' A' ' 130' ' ' ILE . 19.4 mt-10 -78.39 -47.72 17.03 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.149 -0.478 . . . . 73.31 110.875 -179.906 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 65.2 t80 -54.33 -36.24 63.55 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.152 -0.476 . . . . 73.32 110.912 -179.936 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 142' ' ' VAL . . . . . 0.834 HG22 HG21 ' A' ' 85' ' ' ILE . 90.0 t -70.81 -43.04 77.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.147 -0.479 . . . . 42.13 111.16 179.93 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 20.5 tt0 -68.35 -29.98 68.83 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.162 -0.472 . . . . 73.44 110.872 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 7.9 tpt -72.03 -56.6 5.35 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.254 -0.43 . . . . 61.33 110.897 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 9.7 ttm -65.91 -26.06 67.44 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.256 -0.429 . . . . 65.24 110.891 179.927 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 2.1 m -108.29 21.28 17.55 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.238 -0.437 . . . . 73.33 111.135 -179.92 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -51.74 127.37 20.5 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.234 -0.439 . . . . 65.01 111.145 179.826 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 9.9 mmmt . . . . . 0 C--N 1.329 -0.301 0 CA-C-N 116.205 -0.452 . . . . 71.35 110.895 179.996 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' M' M ' 8' ' ' LEU . . . . . . . . . . . . . 17.4 mt . . . . . 0 C--O 1.232 0.142 0 CA-C-O 120.844 0.354 . . . . 74.13 110.868 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' M' M ' 9' ' ' SER . . . . . . . . . . . . . 74.0 m -137.16 168.37 19.74 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.167 -0.47 . . . . 75.33 110.866 -179.957 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' M' M ' 10' ' ' GLY . . . . . . . . . . . . . . . 148.84 54.04 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.805 -0.712 . . . . 52.14 112.509 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' M' M ' 11' ' ' GLY . . . . . . . . . . . . . . . 154.39 -126.75 1.96 Allowed Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.762 -0.732 . . . . 65.21 112.454 -179.919 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' M' M ' 12' ' ' GLU . . . . . . . . . . . . . 13.4 mm-40 57.19 94.06 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.886 0.374 . . . . 73.32 110.845 -179.85 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' M' M ' 13' ' ' LEU . . . . . 0.581 HD11 ' HG3' ' M' ' 15' ' ' LYS . 35.4 tp -52.66 125.41 16.52 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.198 -0.456 . . . . 75.32 110.909 -179.966 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' M' M ' 14' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -72.16 -30.46 65.01 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.16 -0.473 . . . . 71.01 110.879 179.858 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' M' M ' 15' ' ' LYS . . . . . 0.581 ' HG3' HD11 ' M' ' 13' ' ' LEU . 20.4 mtmm -54.6 -50.77 67.27 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.212 -0.449 . . . . 63.14 110.877 179.978 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' M' M ' 16' ' ' TRP . . . . . 0.547 ' CD1' HD23 ' M' ' 13' ' ' LEU . 26.4 m95 -52.28 -43.13 64.27 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.242 -0.435 . . . . 71.22 110.899 179.948 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' M' M ' 17' ' ' GLU . . . . . . . . . . . . . 24.5 tt0 -54.48 -27.52 38.39 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.223 -0.444 . . . . 72.13 110.903 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' M' M ' 18' ' ' LYS . . . . . . . . . . . . . 15.8 ttpt -69.7 -30.6 68.27 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.157 -0.474 . . . . 62.15 110.899 179.961 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' M' M ' 19' ' ' ILE . . . . . 0.542 HD11 ' HE1' ' A' ' 124' ' ' MET . 43.9 mt -80.91 -25.02 10.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.22 -0.445 . . . . 64.51 111.13 179.867 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' M' M ' 20' ' ' ARG . . . . . . . . . . . . . 31.9 ttm180 -53.28 -28.79 29.7 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.206 -0.452 . . . . 71.42 110.881 179.973 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' M' M ' 21' ' ' LEU . . . . . . . . . . . . . 9.5 mt 58.0 178.73 0.06 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.207 -0.451 . . . . 75.34 110.922 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' M' M ' 22' ' ' ARG . . . . . . . . . . . . . 13.0 ptm180 -179.29 57.15 0.09 OUTLIER Pre-proline 0 C--N 1.328 -0.358 0 CA-C-O 121.634 0.73 . . . . 73.21 110.902 179.951 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' M' M ' 23' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.73 -171.55 0.48 Allowed 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.702 2.268 . . . . 72.14 112.32 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' M' M ' 24' ' ' GLY . . . . . . . . . . . . . . . -146.03 19.57 1.76 Allowed Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.714 -0.755 . . . . 53.32 112.5 179.958 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' M' M ' 25' ' ' GLY . . . . . . . . . . . . . . . -169.95 28.08 0.12 Allowed Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.741 -0.742 . . . . 72.34 112.462 -179.938 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' M' M ' 26' ' ' LYS . . . . . . . . . . . . . 2.3 mmpt? -117.6 26.1 9.95 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.861 0.362 . . . . 74.22 110.874 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' M' M ' 27' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.05 172.05 19.14 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.228 -0.442 . . . . 53.11 110.908 179.818 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' M' M ' 28' ' ' GLN . . . . . . . . . . . . . 4.9 tt0 62.41 173.19 0.14 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.215 -0.448 . . . . 51.41 110.885 179.956 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' M' M ' 29' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -67.51 92.71 0.32 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.207 -0.451 . . . . 74.42 110.895 -179.821 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' M' M ' 30' ' ' LYS . . . . . . . . . . . . . 12.0 tttp -58.06 -22.84 52.13 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.123 -0.489 . . . . 74.5 110.867 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' M' M ' 31' ' ' LEU . . . . . 0.829 HD12 HD12 ' M' ' 34' ' ' ILE . 14.2 tp -70.62 -44.63 66.83 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.254 -0.43 . . . . 55.13 110.921 179.926 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' M' M ' 32' ' ' LYS . . . . . . . . . . . . . 5.7 mtmt -48.63 -44.87 37.73 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.182 -0.463 . . . . 75.45 110.894 179.851 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' M' M ' 33' ' ' HIS . . . . . . . . . . . . . 73.9 t60 -50.39 -39.33 46.65 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.227 -0.442 . . . . 74.1 110.843 179.898 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' M' M ' 34' ' ' ILE . . . . . 0.829 HD12 HD12 ' M' ' 31' ' ' LEU . 66.0 mt -50.6 -39.37 17.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.204 -0.453 . . . . 75.13 111.157 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' M' M ' 35' ' ' VAL . . . . . . . . . . . . . 39.8 t -49.36 -39.8 13.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.179 -0.464 . . . . 63.44 111.121 179.861 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' M' M ' 36' ' ' TRP . . . . . . . . . . . . . 24.2 m0 -58.71 -39.69 81.53 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.182 -0.463 . . . . 75.42 110.918 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' M' M ' 37' ' ' ALA . . . . . 0.957 ' HB3' HD13 ' A' ' 39' ' ' LEU . . . -63.87 -18.72 64.45 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.256 -0.429 . . . . 71.31 111.113 179.829 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' M' M ' 38' ' ' SER . . . . . . . . . . . . . 1.2 m -70.71 -17.91 62.81 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.266 -0.425 . . . . 73.53 110.873 -179.801 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' M' M ' 39' ' ' ARG . . . . . . . . . . . . . 37.2 mtp180 -53.29 -28.62 28.95 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.129 -0.487 . . . . 75.12 110.88 -179.916 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' M' M ' 40' ' ' GLU . . . . . . . . . . . . . 16.0 tp10 -85.98 -47.97 9.11 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.151 -0.477 . . . . 74.33 110.864 -179.912 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' M' M ' 41' ' ' LEU . . . . . 0.589 HD21 ' OG ' ' A' ' 38' ' ' SER . 10.5 mt -64.71 137.94 58.1 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.152 -0.476 . . . . 75.23 110.947 -179.969 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' M' M ' 42' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -143.81 104.74 4.21 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.233 -0.44 . . . . 72.12 110.901 179.977 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' M' M ' 43' ' ' ARG . . . . . . . . . . . . . 60.1 mtp180 . . . . . 0 C--N 1.328 -0.332 0 CA-C-N 116.169 -0.469 . . . . 74.13 110.875 -179.887 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 241' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 262' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 301' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 322' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.087 0 CA-C-O 120.836 0.351 . . . . 71.34 111.101 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 10.9 p-10 -138.33 39.72 2.27 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.195 -0.457 . . . . 62.03 110.871 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 11.8 pt20 -170.41 150.91 3.59 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.192 -0.458 . . . . 73.34 110.91 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.679 HD22 ' HG2' ' A' ' 8' ' ' GLN . 11.4 mt -80.15 140.17 36.49 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.169 -0.469 . . . . 72.54 110.96 179.999 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.697 ' O ' HD12 ' A' ' 9' ' ' ILE . 71.4 p -99.34 174.26 6.38 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.268 -0.424 . . . . 63.02 111.098 179.981 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 21.5 tt0 -55.29 -31.53 61.69 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.218 -0.447 . . . . 73.44 110.858 -179.974 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -67.65 -27.88 67.24 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.163 -0.472 . . . . 71.21 110.898 -179.911 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' GLN . . . . . 0.679 ' HG2' HD22 ' A' ' 4' ' ' LEU . 0.5 OUTLIER -78.0 -46.37 21.2 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.128 -0.487 . . . . 75.1 110.86 -179.916 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ILE . . . . . 0.697 HD12 ' O ' ' A' ' 5' ' ' THR . 3.3 mp -72.19 -40.06 65.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.21 -0.45 . . . . 63.52 111.138 179.977 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -53.59 -32.09 49.6 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.215 -0.448 . . . . 55.01 111.057 179.831 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 27.3 mm-40 -74.79 -52.18 12.15 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.271 -0.422 . . . . 51.24 110.888 -179.894 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 38.1 m-85 -59.55 -45.97 90.24 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.134 -0.485 . . . . 74.42 110.889 -179.938 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 33.0 ttpt -53.87 -35.8 61.96 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.134 -0.485 . . . . 74.15 110.872 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -65.11 -30.85 71.82 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.269 -0.423 . . . . 73.42 110.913 179.978 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -70.68 -48.29 55.5 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.158 -0.474 . . . . 74.52 111.069 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 89.5 t80 -55.65 -54.24 46.59 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.221 -0.445 . . . . 73.03 110.887 -179.91 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 27.7 t -53.92 -29.56 42.67 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.109 -0.496 . . . . 74.22 110.874 -179.792 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 15.6 tp -65.72 -44.32 86.41 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.094 -0.503 . . . . 62.24 110.914 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.644 ' CD1' HG11 ' A' ' 35' ' ' VAL . 56.0 m-85 -75.71 -25.89 57.04 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.153 -0.476 . . . . 75.53 110.888 179.935 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 12.8 t0 -79.53 98.53 6.88 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.16 -0.473 . . . . 53.45 110.889 179.968 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 10.4 ttpp -67.11 -50.75 60.4 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.216 -0.447 . . . . 75.2 110.903 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 24.0 p-10 -81.0 -10.16 59.75 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.206 -0.452 . . . . 74.42 110.919 179.847 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 51.73 42.48 52.61 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.728 -0.749 . . . . 53.1 112.457 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 22.9 p-10 -88.51 -15.79 34.36 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.85 0.357 . . . . 55.52 110.854 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 102.18 17.64 19.65 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.715 -0.755 . . . . 41.02 112.477 -179.938 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -154.64 130.79 10.31 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.777 0.322 . . . . 73.43 111.127 -179.866 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 23.5 mt -97.73 122.38 49.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.167 -0.469 . . . . 72.22 111.12 179.915 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.583 HG22 HG21 ' A' ' 62' ' ' THR . 21.4 p -105.48 176.72 5.07 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.166 -0.47 . . . . 34.34 111.142 179.958 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 72.3 p -61.18 -29.34 69.74 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.239 -0.437 . . . . 71.14 111.129 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 28.4 mmtp -72.7 -49.97 27.9 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.202 -0.454 . . . . 73.04 110.883 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.42 ' O ' HG23 ' A' ' 35' ' ' VAL . 34.9 mt-10 -68.93 -32.68 72.48 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.21 -0.45 . . . . 75.03 110.896 179.988 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.546 HD13 ' O ' ' A' ' 32' ' ' LEU . 1.0 OUTLIER -71.52 -43.35 66.62 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.134 -0.484 . . . . 40.14 110.882 -179.978 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -70.26 -28.14 71.84 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.73 -0.747 . . . . 52.25 112.492 179.903 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 92.9 m -71.91 -58.21 3.65 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.826 0.346 . . . . 64.15 111.114 -179.851 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.644 HG11 ' CD1' ' A' ' 19' ' ' PHE . 96.0 t -51.62 -49.46 34.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.252 -0.431 . . . . 73.43 111.09 179.933 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 6.4 ttt -60.33 -39.31 86.6 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.199 -0.455 . . . . 72.03 110.868 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 51.4 ttp85 -52.74 -43.2 65.58 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.243 -0.435 . . . . 73.04 110.891 -179.944 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' SER . . . . . 0.562 ' OG ' HD21 ' M' ' 41' ' ' LEU . 1.7 t -70.28 -25.23 63.24 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.222 -0.445 . . . . 73.33 110.861 -179.8 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 1.004 HD13 ' HB3' ' M' ' 37' ' ' ALA . 57.1 mt -76.15 -20.92 57.14 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.108 -0.496 . . . . 74.11 110.932 179.981 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 101.48 30.01 6.07 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.771 -0.728 . . . . 71.15 112.511 179.916 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 15.4 mm-40 -128.9 122.56 30.54 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.829 0.347 . . . . 73.41 110.882 -179.897 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 33.7 t-20 -109.93 80.68 1.82 Allowed Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.589 0.709 . . . . 51.44 110.89 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.74 168.03 22.71 Favored 'Trans proline' 0 C--O 1.231 0.158 0 C-N-CA 122.671 2.247 . . . . 65.53 112.346 179.937 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 18.0 p -93.05 158.74 15.63 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.187 -0.46 . . . . 73.43 111.105 -179.938 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.3 pt-20 -51.66 -45.0 63.23 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.197 -0.456 . . . . 74.1 110.893 179.993 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -72.29 -31.32 65.62 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.16 -0.473 . . . . 42.42 111.088 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -69.98 -42.23 73.38 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.208 -0.451 . . . . 74.21 110.838 -179.853 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.51 HD23 HD12 ' A' ' 32' ' ' LEU . 15.1 mt -59.57 -50.98 71.79 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.187 -0.46 . . . . 71.22 110.932 179.969 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -71.91 -28.36 63.43 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.186 -0.461 . . . . 61.42 110.94 179.923 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 7.8 t0 -56.49 -49.8 73.64 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.18 -0.464 . . . . 74.4 110.813 179.978 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' MET . . . . . 0.461 ' HE1' HD11 ' M' ' 34' ' ' ILE . 6.7 ptp -69.49 -37.67 77.34 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.216 -0.447 . . . . 71.34 110.895 -179.957 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 96.5 mt -62.08 -52.48 59.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.191 -0.458 . . . . 73.41 111.126 179.928 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -55.06 -32.95 62.31 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.17 -0.468 . . . . 64.32 110.857 179.952 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -60.4 -55.29 35.36 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.185 -0.461 . . . . 74.13 110.852 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 17.2 m -77.12 -13.1 14.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.215 -0.448 . . . . 74.14 111.108 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 41.9 t0 -66.74 96.39 0.4 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.192 -0.458 . . . . 70.13 110.879 179.916 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.25 -36.81 16.52 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.217 -0.447 . . . . 71.32 111.08 179.959 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -86.45 -0.23 55.57 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.177 -0.465 . . . . 74.54 110.894 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 51.93 60.99 6.89 Favored Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.747 -0.739 . . . . 75.5 112.52 -179.946 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 51.5 p-10 -114.61 -15.89 11.92 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.814 0.34 . . . . 73.12 110.841 -179.822 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 93.82 17.93 39.48 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.709 -0.758 . . . . 74.12 112.446 179.941 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' THR . . . . . 0.583 HG21 HG22 ' A' ' 28' ' ' THR . 70.0 p -151.07 174.29 13.35 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.758 0.313 . . . . 74.04 111.146 -179.819 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.488 HD13 HD21 ' M' ' 31' ' ' LEU . 22.6 mt -104.84 110.93 32.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.279 -0.419 . . . . 75.33 111.163 179.897 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -75.12 -172.98 1.84 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.219 -0.446 . . . . 70.32 110.873 179.874 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.536 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 2.5 t80 -65.52 -58.31 12.18 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-O 121.644 0.735 . . . . 74.41 110.947 -179.916 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' PRO . . . . . 0.536 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 53.7 Cg_endo -69.77 -26.98 27.0 Favored 'Trans proline' 0 C--N 1.341 0.16 0 C-N-CA 122.636 2.224 . . . . 74.33 112.38 179.962 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -60.91 -41.41 96.04 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.186 -0.461 . . . . 75.35 110.879 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 8.3 t80 -74.58 -35.72 63.03 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.154 -0.476 . . . . 73.44 110.909 -179.923 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 18.6 tp -68.76 -54.13 17.82 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.113 -0.494 . . . . 73.53 110.903 -179.976 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 14.6 t -52.97 -28.18 22.55 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.183 -0.462 . . . . 73.33 111.141 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' MET . . . . . 0.44 ' SD ' HD23 ' M' ' 31' ' ' LEU . 43.2 ttp -64.92 -48.35 74.45 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.239 -0.437 . . . . 74.24 110.885 179.881 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 72' ' ' MET . . . . . 0.614 ' HE3' HG21 ' M' ' 35' ' ' VAL . 0.1 OUTLIER -63.34 -38.21 90.26 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.248 -0.433 . . . . 72.32 110.876 179.944 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -74.8 -28.71 60.83 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.268 -0.424 . . . . 65.21 111.098 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 5.1 ttp180 -66.12 -18.98 65.69 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.249 -0.432 . . . . 54.41 110.862 -179.913 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 13.2 pttm -51.2 -30.76 18.15 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.195 -0.457 . . . . 55.32 110.886 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 25.0 tpp -53.82 -57.59 10.36 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.231 -0.441 . . . . 72.55 110.87 179.855 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 12.6 ttmt -172.58 176.25 3.28 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.257 -0.429 . . . . 71.03 110.9 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 12.8 m-20 63.4 80.91 0.22 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.196 -0.456 . . . . 71.24 110.848 179.868 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 14.6 t -163.8 26.75 0.08 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.209 -0.45 . . . . 73.12 111.139 -179.897 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -116.04 -25.08 7.79 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.211 -0.449 . . . . 64.51 110.84 179.911 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 83.7 p -62.87 -27.17 69.16 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.241 -0.436 . . . . 72.22 110.854 -179.778 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -98.13 -30.12 12.84 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.182 -0.463 . . . . 74.21 110.862 -179.926 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 13.1 tt0 -74.2 -45.47 48.09 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.16 -0.473 . . . . 72.15 110.871 -179.936 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -55.51 -35.38 65.55 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.179 -0.464 . . . . 54.04 110.877 -179.908 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.41 HG21 HG22 ' A' ' 142' ' ' VAL . 78.8 mt -63.35 -46.07 96.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.178 -0.464 . . . . 75.14 111.109 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.79 -53.34 13.68 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.182 -0.463 . . . . 75.51 110.889 179.97 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 11.6 tt0 -51.9 -46.37 64.54 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.205 -0.452 . . . . 71.02 110.874 -179.942 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -56.18 -41.44 75.52 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.182 -0.463 . . . . 74.22 111.08 179.936 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 9.4 t80 -54.74 -36.47 64.82 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.256 -0.429 . . . . 71.43 110.863 -179.899 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.76 -47.09 64.25 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.114 -0.494 . . . . 70.02 110.86 -179.888 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 84.5 t -53.22 -28.6 15.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.204 -0.453 . . . . 71.15 111.13 179.974 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.49 ' CE1' HG11 ' A' ' 108' ' ' VAL . 9.4 m-85 -94.9 -28.2 15.32 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.149 -0.478 . . . . 71.54 110.852 -179.959 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 37.9 t0 -81.48 81.72 7.51 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.169 -0.469 . . . . 45.2 110.848 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 4.5 mptp? -76.46 -43.78 38.43 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.228 -0.442 . . . . 75.41 110.87 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 10.0 p30 -72.87 -9.14 58.36 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.215 -0.448 . . . . 63.22 110.837 179.888 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 60.34 30.67 71.77 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.717 -0.754 . . . . 73.43 112.489 -179.925 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 33.8 p-10 -82.35 -16.15 50.23 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.927 0.394 . . . . 32.34 110.922 -179.879 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 80.37 18.73 70.67 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.7 -0.762 . . . . 44.04 112.53 179.969 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 22.8 m-85 -143.52 142.56 31.18 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.859 0.361 . . . . 73.42 110.934 -179.827 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 68.5 mt -103.92 119.46 52.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.173 -0.467 . . . . 74.53 111.106 179.907 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 8.5 p -105.05 -175.42 2.79 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.132 -0.485 . . . . 63.34 110.865 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 102' ' ' ALA . . . . . 0.544 ' O ' HG11 ' A' ' 121' ' ' VAL . . . -74.59 -28.09 60.76 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.104 -0.498 . . . . 43.31 111.083 179.938 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -71.89 -38.34 70.01 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.229 -0.441 . . . . 72.04 111.13 179.968 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -74.06 -44.59 53.69 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.196 -0.457 . . . . 74.13 110.903 -179.963 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 23.3 tp -52.88 -33.74 51.43 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.162 -0.472 . . . . 55.32 110.923 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 106' ' ' ARG . . . . . 0.691 ' O ' HG23 ' A' ' 110' ' ' THR . 53.3 ttp85 -70.57 -44.42 67.42 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.164 -0.471 . . . . 74.22 110.905 179.914 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 2.7 t60 -54.59 -37.24 65.3 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.172 -0.467 . . . . 63.11 110.891 179.986 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.49 HG11 ' CE1' ' A' ' 92' ' ' PHE . 38.4 t -73.47 -33.18 39.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.191 -0.459 . . . . 72.12 111.123 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 109' ' ' MET . . . . . 0.542 ' HG3' HD12 ' A' ' 116' ' ' LEU . 15.4 mmt -70.38 -32.46 70.13 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.186 -0.461 . . . . 65.2 110.902 179.948 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 110' ' ' THR . . . . . 0.691 HG23 ' O ' ' A' ' 106' ' ' ARG . 20.4 p -60.47 -43.02 97.35 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.226 -0.443 . . . . 74.11 111.161 -179.961 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 29.9 m-20 -74.66 -30.18 61.51 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.251 -0.431 . . . . 73.35 110.901 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 14.9 mt -70.69 -26.04 63.25 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.175 -0.466 . . . . 71.44 110.927 179.928 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 100.74 30.9 5.94 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.71 -0.757 . . . . 43.55 112.525 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -125.04 109.97 13.59 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.931 0.396 . . . . 64.53 110.888 -179.856 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 115' ' ' LYS . . . . . 0.509 ' O ' HD23 ' A' ' 116' ' ' LEU . 7.9 ptmm? -75.28 125.97 30.06 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.168 -0.469 . . . . 74.04 110.889 179.992 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.658 HD22 ' HG2' ' A' ' 120' ' ' GLU . 36.2 mt -145.12 163.35 34.58 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.201 -0.454 . . . . 72.21 110.94 179.903 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 117' ' ' THR . . . . . 0.717 ' O ' HG23 ' A' ' 121' ' ' VAL . 23.7 p -118.73 173.7 6.71 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.219 -0.446 . . . . 72.13 111.101 179.971 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -58.01 -38.61 76.48 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.202 -0.454 . . . . 73.31 110.872 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 13.4 tt0 -71.96 -33.6 68.32 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.207 -0.451 . . . . 71.22 110.901 -179.92 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 120' ' ' GLU . . . . . 0.658 ' HG2' HD22 ' A' ' 116' ' ' LEU . 6.2 tp10 -71.1 -44.49 65.54 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.151 -0.477 . . . . 73.05 110.856 -179.951 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.717 HG23 ' O ' ' A' ' 117' ' ' THR . 39.6 t -58.93 -31.6 45.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.203 -0.453 . . . . 75.12 111.15 179.995 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -52.01 -42.3 62.92 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.172 -0.467 . . . . 64.12 110.863 179.906 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 123' ' ' GLU . . . . . 0.666 ' CD ' HD23 ' M' ' 13' ' ' LEU . 68.4 tt0 -57.81 -31.4 66.56 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.222 -0.445 . . . . 75.52 110.908 -179.921 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 30.7 mtp -76.07 -58.76 3.09 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.101 -0.499 . . . . 53.43 110.897 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.435 HG13 ' HB2' ' A' ' 102' ' ' ALA . 35.9 mm -53.9 -35.71 28.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.215 -0.448 . . . . 73.31 111.149 179.932 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 38.8 ttt180 -63.42 -31.85 73.13 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.175 -0.466 . . . . 73.15 110.91 179.931 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 -74.58 -52.38 11.95 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.198 -0.456 . . . . 72.03 110.88 -179.94 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.675 ' HB3' HG22 ' A' ' 136' ' ' VAL . . . -65.34 -34.43 78.3 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.137 -0.483 . . . . 54.3 111.078 179.999 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 49.3 t0 -68.43 86.72 0.3 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.184 -0.462 . . . . 72.24 110.859 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 59.0 mt -79.82 -46.22 22.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.181 -0.463 . . . . 70.42 111.135 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 21.2 p30 -72.78 -8.69 56.65 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.202 -0.454 . . . . 71.13 110.869 179.845 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 62.79 42.71 99.64 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.738 -0.744 . . . . 64.31 112.46 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 34.7 p-10 -87.75 -15.9 35.71 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.867 0.365 . . . . 74.01 110.914 179.99 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 104.1 2.34 45.15 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.719 -0.753 . . . . 72.43 112.473 -179.941 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 4.2 tt0 -149.21 172.23 15.18 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.808 0.337 . . . . 64.4 110.921 -179.858 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 136' ' ' VAL . . . . . 0.675 HG22 ' HB3' ' A' ' 128' ' ' ALA . 98.7 t -106.91 109.98 30.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.185 -0.461 . . . . 61.42 111.132 179.913 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 20.2 p30 -90.99 165.12 13.71 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.159 -0.473 . . . . 55.11 110.885 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 34.2 t80 -52.16 -46.76 65.6 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.155 -0.475 . . . . 63.0 110.919 -179.912 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 19.0 tp10 -52.0 -40.15 60.54 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.15 -0.477 . . . . 74.21 110.835 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 22.9 mt-10 -78.4 -32.68 48.91 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.206 -0.452 . . . . 74.21 110.916 -179.935 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 65.5 t80 -67.8 -39.01 84.03 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.152 -0.476 . . . . 73.01 110.89 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 142' ' ' VAL . . . . . 0.41 HG22 HG21 ' A' ' 85' ' ' ILE . 95.7 t -71.25 -50.85 38.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.148 -0.478 . . . . 72.24 111.142 179.96 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 14.9 tt0 -61.32 -38.68 87.77 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.221 -0.445 . . . . 74.11 110.898 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 15.4 tpt -68.9 -55.58 10.6 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.218 -0.446 . . . . 72.32 110.862 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 12.5 ttm -60.54 -29.54 69.2 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.234 -0.439 . . . . 73.42 110.921 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 1.8 m -105.74 21.31 17.47 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.192 -0.458 . . . . 64.45 111.143 -179.927 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -51.83 131.16 30.5 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.207 -0.451 . . . . 72.43 111.1 179.839 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 22.9 pttm . . . . . 0 C--N 1.329 -0.32 0 CA-C-N 116.212 -0.449 . . . . 74.31 110.842 179.988 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' M' M ' 8' ' ' LEU . . . . . . . . . . . . . 3.1 pp . . . . . 0 C--O 1.231 0.12 0 CA-C-O 120.813 0.34 . . . . 75.12 110.908 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' M' M ' 9' ' ' SER . . . . . . . . . . . . . 79.6 p -143.59 160.28 40.92 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.205 -0.452 . . . . 45.32 110.908 -179.906 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' M' M ' 10' ' ' GLY . . . . . . . . . . . . . . . -112.28 -171.64 18.65 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.741 -0.743 . . . . 73.44 112.474 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' M' M ' 11' ' ' GLY . . . . . . . . . . . . . . . 73.29 29.15 64.7 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.729 -0.748 . . . . 52.12 112.486 -179.87 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' M' M ' 12' ' ' GLU . . . . . . . . . . . . . 20.0 mt-10 -143.65 -170.81 3.39 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.908 0.385 . . . . 64.32 110.892 -179.917 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' M' M ' 13' ' ' LEU . . . . . 0.666 HD23 ' CD ' ' A' ' 123' ' ' GLU . 1.0 OUTLIER -87.44 76.65 9.0 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.169 -0.469 . . . . 60.13 110.91 -179.994 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' M' M ' 14' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -102.43 23.7 11.44 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.21 -0.45 . . . . 72.33 110.894 179.819 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' M' M ' 15' ' ' LYS . . . . . 0.433 ' HB3' ' HE3' ' A' ' 109' ' ' MET . 41.1 mttp -77.0 -49.95 14.26 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.14 -0.482 . . . . 71.1 110.885 179.988 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' M' M ' 16' ' ' TRP . . . . . 0.62 ' CE3' HD12 ' M' ' 19' ' ' ILE . 12.0 m95 -53.01 -40.56 63.93 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.233 -0.439 . . . . 72.45 110.912 179.96 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' M' M ' 17' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -56.35 -26.05 51.32 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.267 -0.424 . . . . 62.04 110.923 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' M' M ' 18' ' ' LYS . . . . . . . . . . . . . 29.1 tttp -78.69 -26.58 44.95 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.146 -0.479 . . . . 63.04 110.908 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' M' M ' 19' ' ' ILE . . . . . 0.62 HD12 ' CE3' ' M' ' 16' ' ' TRP . 39.3 mt -87.79 -25.18 6.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.226 -0.443 . . . . 74.55 111.1 179.88 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' M' M ' 20' ' ' ARG . . . . . . . . . . . . . 25.5 ttp180 -52.11 -37.55 54.49 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.228 -0.442 . . . . 73.44 110.864 179.962 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' M' M ' 21' ' ' LEU . . . . . . . . . . . . . 7.8 mt 55.31 -175.36 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.19 -0.459 . . . . 73.33 110.929 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' M' M ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -139.14 149.16 60.12 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.619 0.723 . . . . 74.43 110.895 179.971 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' M' M ' 23' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.73 101.42 0.9 Allowed 'Trans proline' 0 C--N 1.342 0.201 0 C-N-CA 122.651 2.234 . . . . 71.22 112.343 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' M' M ' 24' ' ' GLY . . . . . . . . . . . . . . . -145.89 39.56 1.13 Allowed Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.69 -0.766 . . . . 54.32 112.437 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' M' M ' 25' ' ' GLY . . . . . . . . . . . . . . . -130.78 171.94 20.69 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.746 -0.74 . . . . 44.53 112.501 -179.924 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' M' M ' 26' ' ' LYS . . . . . . . . . . . . . 4.2 ttpm? -78.04 -73.05 0.33 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.834 0.349 . . . . 62.35 110.884 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' M' M ' 27' ' ' LYS . . . . . . . . . . . . . 5.4 mptp? 58.84 176.9 0.07 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.206 -0.452 . . . . 65.43 110.87 179.864 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' M' M ' 28' ' ' GLN . . . . . . . . . . . . . 2.4 pp0? -179.14 173.91 1.1 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.212 -0.449 . . . . 52.32 110.916 179.978 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' M' M ' 29' ' ' TYR . . . . . . . . . . . . . 11.7 m-85 -90.69 126.96 36.14 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.218 -0.446 . . . . 74.13 110.925 -179.897 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' M' M ' 30' ' ' LYS . . . . . . . . . . . . . 15.8 tttp -88.47 8.18 29.23 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.108 -0.496 . . . . 70.21 110.859 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' M' M ' 31' ' ' LEU . . . . . 0.643 HD12 HD12 ' M' ' 34' ' ' ILE . 15.5 tp -106.77 -49.77 3.24 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.233 -0.44 . . . . 63.42 110.955 179.918 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' M' M ' 32' ' ' LYS . . . . . . . . . . . . . 39.7 tttm -48.23 -45.78 34.59 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.158 -0.473 . . . . 73.52 110.912 179.789 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' M' M ' 33' ' ' HIS . . . . . . . . . . . . . 19.8 t-160 -51.21 -39.3 56.21 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.257 -0.429 . . . . 64.11 110.88 179.881 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' M' M ' 34' ' ' ILE . . . . . 0.643 HD12 HD12 ' M' ' 31' ' ' LEU . 72.5 mt -51.18 -37.78 18.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.196 -0.456 . . . . 64.45 111.186 179.982 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' M' M ' 35' ' ' VAL . . . . . 0.614 HG21 ' HE3' ' A' ' 72' ' ' MET . 46.3 t -49.11 -39.11 12.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.157 -0.474 . . . . 64.45 111.133 179.86 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' M' M ' 36' ' ' TRP . . . . . . . . . . . . . 19.5 m0 -58.44 -40.03 81.47 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.154 -0.475 . . . . 74.25 110.892 179.967 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' M' M ' 37' ' ' ALA . . . . . 1.004 ' HB3' HD13 ' A' ' 39' ' ' LEU . . . -63.2 -18.7 63.78 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.191 -0.459 . . . . 75.31 111.097 179.931 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' M' M ' 38' ' ' SER . . . . . . . . . . . . . 1.5 m -68.24 -18.07 64.46 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.185 -0.462 . . . . 70.45 110.853 -179.727 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' M' M ' 39' ' ' ARG . . . . . . . . . . . . . 41.2 mtp180 -52.49 -29.56 25.54 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.087 -0.506 . . . . 43.23 110.862 -179.946 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' M' M ' 40' ' ' GLU . . . . . . . . . . . . . 21.7 mt-10 -82.06 -48.05 11.87 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.178 -0.465 . . . . 64.35 110.892 -179.915 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' M' M ' 41' ' ' LEU . . . . . 0.562 HD21 ' OG ' ' A' ' 38' ' ' SER . 9.8 mt -62.36 175.63 0.73 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.184 -0.462 . . . . 72.34 110.929 179.998 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' M' M ' 42' ' ' GLU . . . . . . . . . . . . . 56.5 mt-10 -150.01 -178.76 6.67 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.214 -0.448 . . . . 51.21 110.93 179.905 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' M' M ' 43' ' ' ARG . . . . . . . . . . . . . 2.6 tmm_? . . . . . 0 C--N 1.329 -0.285 0 CA-C-N 116.155 -0.475 . . . . 73.33 110.863 -179.92 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 241' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 262' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 301' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 322' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.103 0 CA-C-O 120.858 0.361 . . . . 64.12 111.089 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 46.7 m-20 -69.39 143.71 53.6 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.172 -0.467 . . . . 74.35 110.855 -179.982 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 43.3 mm-40 -95.83 -34.85 11.71 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.211 -0.45 . . . . 73.34 110.868 -179.867 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 10.6 mt -105.9 146.84 29.45 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.204 -0.453 . . . . 72.44 110.904 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 4.2 p -120.45 177.08 5.18 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.218 -0.446 . . . . 71.22 111.146 179.938 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 66.6 tt0 -57.48 -29.87 64.63 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.208 -0.451 . . . . 55.04 110.852 -179.923 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -68.0 -40.69 82.96 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.181 -0.463 . . . . 63.14 110.863 -179.931 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 35.0 tt0 -78.02 -36.75 48.31 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.182 -0.463 . . . . 63.22 110.878 -179.901 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 62.1 mt -72.53 -37.68 57.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.246 -0.434 . . . . 73.24 111.143 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -56.03 -45.23 79.23 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.115 -0.493 . . . . 62.15 111.082 179.872 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -66.44 -32.2 73.42 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.2 -0.455 . . . . 64.24 110.921 -179.958 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.413 ' HB3' HD13 ' A' ' 69' ' ' LEU . 9.4 m-85 -73.44 -45.93 51.44 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.119 -0.491 . . . . 63.43 110.888 -179.95 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 34.9 ttmt -56.76 -37.61 71.29 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.172 -0.467 . . . . 63.42 110.907 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -59.92 -30.69 69.22 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.272 -0.422 . . . . 75.54 110.891 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -67.26 -42.39 83.97 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.174 -0.466 . . . . 63.22 111.119 179.933 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 40.8 t80 -58.16 -54.13 50.39 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.238 -0.437 . . . . 65.33 110.891 -179.928 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 6.8 t -52.26 -31.09 30.84 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.146 -0.479 . . . . 75.24 110.833 -179.814 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 16.2 tp -65.74 -49.34 68.78 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.187 -0.461 . . . . 71.24 110.919 179.996 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.826 ' HA ' HG21 ' A' ' 35' ' ' VAL . 33.1 m-85 -72.28 -25.97 61.8 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.178 -0.464 . . . . 75.52 110.853 179.96 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 13.5 t0 -86.05 98.53 10.9 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.163 -0.472 . . . . 64.44 110.901 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 6.7 tppt? -68.96 -52.78 25.42 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.23 -0.441 . . . . 71.34 110.869 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 24.1 p-10 -77.08 -10.08 59.15 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.241 -0.436 . . . . 75.31 110.913 179.861 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 52.11 48.4 52.77 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.773 -0.727 . . . . 64.1 112.433 -179.978 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 31.8 p-10 -88.53 -15.71 34.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.818 0.342 . . . . 74.34 110.889 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 105.41 -11.64 47.25 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.718 -0.753 . . . . 72.3 112.5 -179.925 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 4.2 p -132.13 130.7 41.5 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.712 0.292 . . . . 72.31 111.151 -179.873 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.487 HG22 ' HB2' ' A' ' 32' ' ' LEU . 23.2 mt -89.7 114.01 26.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.239 -0.437 . . . . 64.25 111.117 179.906 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.583 HG22 HG21 ' A' ' 62' ' ' THR . 44.8 p -93.38 170.67 9.44 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.216 -0.447 . . . . 74.53 111.113 179.957 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.584 HG22 HD12 ' A' ' 52' ' ' ILE . 82.4 p -58.17 -34.47 70.35 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.213 -0.449 . . . . 72.25 111.119 -179.955 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 30.8 tptt -79.84 -50.13 10.96 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.213 -0.448 . . . . 74.34 110.922 179.882 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.53 ' OE1' HG23 ' A' ' 28' ' ' THR . 60.1 mt-10 -59.03 -34.69 72.2 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.189 -0.46 . . . . 72.41 110.928 179.931 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.487 ' HB2' HG22 ' A' ' 27' ' ' ILE . 4.1 tt -74.22 -55.68 5.78 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.138 -0.483 . . . . 73.5 110.894 -179.986 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -52.3 -27.87 25.64 Favored Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.752 -0.737 . . . . 73.34 112.485 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 96.3 m -58.5 -58.06 10.2 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.838 0.352 . . . . 61.23 111.131 -179.821 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.826 HG21 ' HA ' ' A' ' 19' ' ' PHE . 98.7 t -56.21 -47.55 80.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.225 -0.443 . . . . 72.23 111.084 179.933 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 7.0 mtp -51.86 -41.36 61.8 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.201 -0.454 . . . . 72.03 110.879 179.897 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 27.9 ttt180 -53.09 -45.44 68.2 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.244 -0.435 . . . . 65.43 110.829 -179.896 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' SER . . . . . 0.655 ' OG ' HD11 ' M' ' 41' ' ' LEU . 1.8 p -61.25 -26.14 67.55 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.247 -0.433 . . . . 64.34 110.843 -179.739 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.996 HD13 ' HB3' ' M' ' 37' ' ' ALA . 18.0 mt -89.86 -16.35 30.27 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.163 -0.472 . . . . 72.45 110.889 -180.0 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 101.44 27.34 7.26 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.725 -0.75 . . . . 64.42 112.467 179.853 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 22.0 mm100 -116.88 106.5 13.52 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.78 0.324 . . . . 61.25 110.901 -179.916 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 14.6 t-20 -109.99 76.56 1.0 Allowed Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 121.637 0.732 . . . . 74.21 110.865 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.75 168.09 22.55 Favored 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.656 2.237 . . . . 72.31 112.334 179.925 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 19.0 p -87.6 156.67 19.39 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.195 -0.457 . . . . 63.13 111.162 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -51.8 -41.77 61.96 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.205 -0.452 . . . . 61.32 110.893 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.23 -32.16 64.58 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.187 -0.46 . . . . 71.44 111.098 179.901 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 68.3 tt0 -68.86 -50.08 52.83 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.222 -0.445 . . . . 64.23 110.915 -179.887 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 16.0 mt -55.12 -45.24 75.54 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.087 -0.506 . . . . 64.24 110.922 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 3.8 tm0? -71.77 -28.68 63.8 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.166 -0.47 . . . . 73.11 110.895 179.917 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -63.71 -49.76 71.82 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.231 -0.44 . . . . 74.45 110.901 179.946 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 5.5 ptp -66.2 -37.47 85.68 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.19 -0.459 . . . . 62.33 110.872 179.988 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.584 HD12 HG22 ' A' ' 29' ' ' THR . 66.0 mt -67.07 -38.1 80.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.203 -0.453 . . . . 72.41 111.059 -179.958 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 14.3 m-20 -59.58 -37.63 79.05 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.231 -0.44 . . . . 75.3 110.881 179.935 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 70.0 mm-40 -61.98 -47.95 82.52 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.196 -0.456 . . . . 61.41 110.897 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 16.9 m -77.81 -15.24 14.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.141 -0.482 . . . . 62.13 111.099 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 37.3 t0 -66.8 94.26 0.3 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.223 -0.444 . . . . 72.45 110.861 179.929 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.27 -35.92 16.99 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.182 -0.463 . . . . 53.22 111.11 179.945 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 1.9 p-10 -88.67 -0.17 57.02 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.235 -0.439 . . . . 70.14 110.867 179.996 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 54.5 60.09 9.12 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.746 -0.74 . . . . 61.11 112.5 -179.913 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 50.9 p-10 -114.6 -15.79 11.94 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.912 0.386 . . . . 72.44 110.91 -179.921 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 93.4 13.26 56.06 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.771 -0.728 . . . . 53.13 112.504 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' THR . . . . . 0.583 HG21 HG22 ' A' ' 28' ' ' THR . 70.3 p -150.65 171.93 16.36 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.732 0.301 . . . . 75.5 111.157 -179.88 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 16.1 mt -96.1 115.17 34.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.223 -0.444 . . . . 73.43 111.1 179.947 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.7 t0 -78.78 -175.26 4.35 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.18 -0.464 . . . . 61.35 110.884 179.866 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.531 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 2.5 t80 -63.5 -58.37 15.75 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.634 0.73 . . . . 72.13 110.898 -179.888 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 66' ' ' PRO . . . . . 0.531 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 53.6 Cg_endo -69.79 -30.64 21.82 Favored 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.624 2.216 . . . . 74.24 112.343 -179.994 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 55.8 mt-10 -59.0 -40.77 85.91 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.268 -0.424 . . . . 71.33 110.909 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 12.7 t80 -74.17 -35.68 64.02 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.171 -0.468 . . . . 73.41 110.911 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.413 HD13 ' HB3' ' A' ' 12' ' ' PHE . 27.6 tp -68.4 -53.88 20.86 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.141 -0.482 . . . . 43.21 110.937 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 15.3 t -53.63 -29.17 36.88 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.184 -0.462 . . . . 61.12 111.133 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' MET . . . . . 0.495 ' HE3' HD11 ' M' ' 31' ' ' LEU . 35.4 ttp -62.78 -43.49 98.66 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.237 -0.438 . . . . 70.4 110.856 179.964 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 72' ' ' MET . . . . . 0.585 ' HE3' HG11 ' M' ' 35' ' ' VAL . 3.3 mmt -71.4 -29.72 65.25 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.236 -0.438 . . . . 71.31 110.9 179.927 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -60.2 -28.73 68.22 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.226 -0.443 . . . . 62.51 111.136 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -63.01 -24.5 67.95 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.162 -0.472 . . . . 62.25 110.898 -179.91 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 12.7 ttpt -51.83 -30.18 22.42 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.165 -0.471 . . . . 71.43 110.93 179.918 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 3.2 tmm? -52.14 -32.93 37.82 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.208 -0.451 . . . . 72.03 110.855 179.902 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 21.7 ttmm -73.24 -68.58 0.48 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.274 -0.421 . . . . 65.12 110.912 179.935 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 52.0 t0 52.13 79.19 0.11 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.248 -0.433 . . . . 75.13 110.868 179.844 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 4.0 m -78.99 69.27 5.12 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.164 -0.471 . . . . 54.42 111.145 -179.902 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -166.41 -39.52 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.249 -0.432 . . . . 65.33 110.839 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 3.3 m -61.49 -46.07 91.57 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.222 -0.444 . . . . 44.14 110.808 -179.678 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -52.34 -29.87 25.83 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.19 -0.459 . . . . 72.03 110.881 -179.958 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 28.7 tt0 -72.36 -37.42 68.8 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.136 -0.484 . . . . 73.42 110.903 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -77.76 -43.97 29.1 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.166 -0.47 . . . . 74.22 110.861 -179.915 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.458 HG21 ' HA ' ' A' ' 142' ' ' VAL . 70.6 mt -56.91 -50.96 73.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.146 -0.479 . . . . 75.44 111.181 179.958 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 45.7 ttp180 -62.5 -28.32 69.75 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.176 -0.465 . . . . 64.12 110.924 179.924 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.73 ' O ' HG23 ' A' ' 91' ' ' VAL . 10.0 mm-40 -76.13 -46.87 26.63 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.207 -0.451 . . . . 73.51 110.922 179.983 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 88' ' ' ALA . . . . . 0.628 ' HB1' ' CE2' ' A' ' 92' ' ' PHE . . . -63.75 -42.68 97.8 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.171 -0.468 . . . . 74.25 111.1 179.924 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 9.9 t80 -52.02 -50.69 60.9 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.211 -0.45 . . . . 74.32 110.88 -179.905 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 32.1 ttm180 -62.75 -35.98 81.56 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.141 -0.481 . . . . 73.23 110.858 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' VAL . . . . . 0.73 HG23 ' O ' ' A' ' 87' ' ' GLU . 85.3 t -63.91 -42.67 96.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.186 -0.461 . . . . 73.11 111.134 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.628 ' CE2' ' HB1' ' A' ' 88' ' ' ALA . 9.2 m-85 -78.2 -31.18 49.31 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.157 -0.474 . . . . 75.44 110.899 -179.983 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 22.7 t0 -61.25 96.91 0.06 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.168 -0.469 . . . . 75.45 110.894 179.98 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 13.4 mmmt -77.35 -53.34 7.8 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.23 -0.441 . . . . 61.14 110.872 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 16.5 p30 -74.25 -9.19 58.36 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.226 -0.443 . . . . 64.55 110.838 179.902 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 59.69 25.86 61.78 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.75 -0.738 . . . . 54.1 112.465 -179.917 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 40.5 p-10 -82.11 -16.16 50.91 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.824 0.345 . . . . 73.45 110.901 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 86.7 18.7 57.93 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.735 -0.745 . . . . 73.22 112.485 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 13.0 m-85 -137.85 134.27 34.9 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.888 0.375 . . . . 73.11 110.933 -179.816 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 71.4 mt -100.04 125.6 53.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.098 -0.501 . . . . 51.52 111.102 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 86.0 p -109.17 -172.81 2.12 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.198 -0.455 . . . . 63.14 110.885 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 102' ' ' ALA . . . . . 0.517 ' HB1' ' CG1' ' A' ' 121' ' ' VAL . . . -72.74 -37.11 67.81 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.114 -0.494 . . . . 52.44 111.074 179.883 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -70.24 -49.92 45.1 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.238 -0.437 . . . . 51.2 111.101 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -62.56 -48.5 79.19 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.227 -0.442 . . . . 75.43 110.867 -179.911 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.44 HD11 ' CD1' ' M' ' 19' ' ' ILE . 30.4 tp -56.35 -26.85 54.06 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.169 -0.468 . . . . 74.4 110.904 -179.933 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 106' ' ' ARG . . . . . 0.451 ' O ' HG23 ' A' ' 110' ' ' THR . 17.9 ttm180 -73.35 -29.04 62.39 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.175 -0.466 . . . . 63.22 110.875 179.938 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 19.8 t60 -66.95 -34.69 78.32 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.191 -0.459 . . . . 73.1 110.871 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 40.9 t -74.49 -39.58 47.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.17 -0.468 . . . . 72.32 111.168 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 2.3 mmt -73.87 -38.69 64.34 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.164 -0.471 . . . . 61.55 110.913 179.857 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 110' ' ' THR . . . . . 0.451 HG23 ' O ' ' A' ' 106' ' ' ARG . 3.0 p -54.12 -32.75 56.0 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.209 -0.45 . . . . 74.43 111.165 -179.935 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -74.68 -28.35 60.79 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.218 -0.446 . . . . 74.02 110.887 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -70.68 -25.95 63.21 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.19 -0.459 . . . . 74.13 110.933 179.947 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 100.84 19.4 17.51 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.73 -0.748 . . . . 52.43 112.518 179.93 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -102.81 127.9 49.79 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.873 0.368 . . . . 73.4 110.896 -179.874 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 34.0 mttp -80.83 117.51 21.55 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.186 -0.461 . . . . 73.32 110.929 179.945 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 15.3 mt -130.02 113.34 14.44 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.253 -0.43 . . . . 75.03 110.909 179.933 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 117' ' ' THR . . . . . 0.588 ' O ' HG23 ' A' ' 121' ' ' VAL . 75.1 p -81.91 171.22 14.71 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.17 -0.468 . . . . 71.12 111.156 179.932 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 46.7 m-20 -52.01 -36.68 50.78 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.238 -0.437 . . . . 74.04 110.826 179.9 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -75.23 -33.4 61.35 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.163 -0.471 . . . . 73.11 110.928 -179.91 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -69.63 -42.19 74.62 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.111 -0.495 . . . . 64.14 110.906 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.588 HG23 ' O ' ' A' ' 117' ' ' THR . 21.8 t -61.03 -38.62 79.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.163 -0.471 . . . . 72.12 111.119 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 50.0 t0 -56.88 -45.48 82.49 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.212 -0.449 . . . . 65.51 110.9 179.901 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 15.5 tm-20 -57.51 -34.26 68.91 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.193 -0.458 . . . . 73.32 110.839 -179.924 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 124' ' ' MET . . . . . 0.406 ' HE2' ' HG3' ' M' ' 15' ' ' LYS . 27.1 mtp -70.69 -59.56 2.75 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.2 -0.454 . . . . 62.33 110.862 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.45 HG13 ' HB2' ' A' ' 102' ' ' ALA . 36.3 mm -53.97 -35.5 28.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.211 -0.449 . . . . 74.31 111.134 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 56.5 ttt85 -63.07 -31.84 73.08 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.171 -0.468 . . . . 75.55 110.863 179.986 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -75.11 -52.38 11.14 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.148 -0.478 . . . . 64.02 110.9 -179.959 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.659 ' HB3' HG22 ' A' ' 136' ' ' VAL . . . -64.88 -34.41 78.32 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.168 -0.469 . . . . 73.25 111.126 179.909 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 49.0 t0 -68.37 86.9 0.29 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.197 -0.456 . . . . 74.1 110.853 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 64.7 mt -79.85 -46.61 22.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.178 -0.465 . . . . 74.12 111.145 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 21.5 p30 -72.63 -8.69 56.53 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.175 -0.466 . . . . 74.52 110.865 179.848 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 62.86 43.02 99.54 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.73 -0.748 . . . . 44.32 112.497 -179.944 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 34.5 p-10 -88.51 -15.91 34.05 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.865 0.364 . . . . 52.02 110.869 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 104.14 2.35 45.03 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.768 -0.729 . . . . 64.15 112.468 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 5.3 tt0 -149.21 172.29 15.08 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.814 0.34 . . . . 61.22 110.913 -179.902 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 136' ' ' VAL . . . . . 0.659 HG22 ' HB3' ' A' ' 128' ' ' ALA . 72.4 t -106.83 109.28 27.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.185 -0.462 . . . . 62.22 111.111 179.977 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 20.9 p30 -91.27 164.79 13.75 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.159 -0.473 . . . . 50.24 110.859 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 138' ' ' TYR . . . . . 0.583 ' O ' HG23 ' A' ' 142' ' ' VAL . 37.5 t80 -52.25 -46.22 65.68 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.185 -0.462 . . . . 65.41 110.923 -179.97 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -51.91 -39.74 59.58 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.117 -0.492 . . . . 72.24 110.868 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 26.1 mt-10 -78.38 -37.36 44.32 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.172 -0.467 . . . . 52.53 110.887 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 36.8 t80 -63.95 -39.61 94.55 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.135 -0.484 . . . . 64.41 110.855 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 142' ' ' VAL . . . . . 0.583 HG23 ' O ' ' A' ' 138' ' ' TYR . 90.9 t -63.74 -50.72 76.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.175 -0.466 . . . . 61.0 111.119 -179.996 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 143' ' ' GLN . . . . . 0.548 ' HA ' HG22 ' A' ' 146' ' ' THR . 43.3 tt0 -70.8 -23.38 62.36 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.181 -0.463 . . . . 73.23 110.927 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 11.7 tpt -75.03 -18.73 60.29 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.157 -0.474 . . . . 72.2 110.904 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 145' ' ' MET . . . . . 0.499 ' HE2' ' HA ' ' M' ' 20' ' ' ARG . 5.8 ttm -98.2 -32.98 11.3 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.225 -0.443 . . . . 72.02 110.856 179.954 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 146' ' ' THR . . . . . 0.548 HG22 ' HA ' ' A' ' 143' ' ' GLN . 5.0 t -73.38 -24.02 60.26 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.256 -0.429 . . . . 35.21 111.128 -179.918 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -100.27 -75.43 0.58 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.239 -0.437 . . . . 51.43 111.1 179.854 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.348 0 CA-C-N 116.246 -0.434 . . . . 72.35 110.881 179.959 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' M' M ' 8' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.231 0.131 0 CA-C-O 120.852 0.358 . . . . 64.45 110.913 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' M' M ' 9' ' ' SER . . . . . . . . . . . . . 2.8 t -156.5 157.67 35.86 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.202 -0.453 . . . . 74.42 110.879 -179.937 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' M' M ' 10' ' ' GLY . . . . . . . . . . . . . . . -69.4 -28.69 72.24 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.744 -0.741 . . . . 75.24 112.514 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' M' M ' 11' ' ' GLY . . . . . . . . . . . . . . . -90.61 -159.92 36.06 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.719 -0.753 . . . . 53.33 112.475 -179.923 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' M' M ' 12' ' ' GLU . . . . . . . . . . . . . 47.0 tp10 53.98 89.06 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.878 0.371 . . . . 64.42 110.862 -179.848 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' M' M ' 13' ' ' LEU . . . . . 0.51 HD22 ' HB3' ' M' ' 15' ' ' LYS . 1.6 tt -88.5 121.26 30.69 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.16 -0.473 . . . . 61.45 110.919 179.996 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' M' M ' 14' ' ' ASP . . . . . 0.455 ' N ' HD23 ' M' ' 13' ' ' LEU . 10.3 t70 -98.06 61.31 1.5 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.178 -0.464 . . . . 73.12 110.873 179.844 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' M' M ' 15' ' ' LYS . . . . . 0.51 ' HB3' HD22 ' M' ' 13' ' ' LEU . 0.4 OUTLIER -79.18 -22.92 44.28 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.182 -0.463 . . . . 74.22 110.939 179.988 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' M' M ' 16' ' ' TRP . . . . . 0.581 ' CZ3' HD12 ' M' ' 19' ' ' ILE . 3.1 m95 -51.94 -38.59 57.04 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.222 -0.445 . . . . 72.54 110.865 179.908 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' M' M ' 17' ' ' GLU . . . . . . . . . . . . . 58.4 tt0 -56.07 -30.91 62.68 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.251 -0.431 . . . . 73.21 110.944 -179.959 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' M' M ' 18' ' ' LYS . . . . . . . . . . . . . 6.5 tppt? -52.02 -30.41 25.28 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.13 -0.486 . . . . 72.52 110.892 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' M' M ' 19' ' ' ILE . . . . . 0.581 HD12 ' CZ3' ' M' ' 16' ' ' TRP . 64.1 mt -91.31 -24.54 5.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.167 -0.47 . . . . 74.2 111.088 179.901 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' M' M ' 20' ' ' ARG . . . . . 0.499 ' HA ' ' HE2' ' A' ' 145' ' ' MET . 12.1 ttm180 -66.87 -25.83 66.6 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.204 -0.453 . . . . 72.1 110.835 -179.976 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' M' M ' 21' ' ' LEU . . . . . . . . . . . . . 46.9 mt 60.75 -173.86 0.12 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.213 -0.449 . . . . 62.22 110.919 -179.931 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' M' M ' 22' ' ' ARG . . . . . . . . . . . . . 8.6 mpt_? -104.8 144.23 28.3 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-O 121.579 0.704 . . . . 75.25 110.865 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' M' M ' 23' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.76 -176.81 1.61 Allowed 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.663 2.242 . . . . 45.41 112.354 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' M' M ' 24' ' ' GLY . . . . . . . . . . . . . . . 140.72 127.67 2.36 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.773 -0.727 . . . . 71.31 112.515 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' M' M ' 25' ' ' GLY . . . . . . . . . . . . . . . 164.82 -167.12 38.42 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.723 -0.751 . . . . 54.45 112.515 -179.924 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' M' M ' 26' ' ' LYS . . . . . . . . . . . . . 12.8 ptmt -63.13 -27.28 69.27 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.834 0.349 . . . . 71.4 110.898 179.998 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' M' M ' 27' ' ' LYS . . . . . . . . . . . . . 10.8 mttm 62.8 -172.87 0.16 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.243 -0.435 . . . . 73.12 110.874 179.844 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' M' M ' 28' ' ' GLN . . . . . . . . . . . . . 22.7 mm100 -75.93 -74.19 0.23 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.209 -0.45 . . . . 45.03 110.897 179.981 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' M' M ' 29' ' ' TYR . . . . . . . . . . . . . 13.7 m-85 -92.75 179.89 5.35 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.187 -0.461 . . . . 74.43 110.927 -179.841 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' M' M ' 30' ' ' LYS . . . . . . . . . . . . . 14.5 mtmm -101.89 -21.21 14.59 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.173 -0.467 . . . . 73.31 110.889 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' M' M ' 31' ' ' LEU . . . . . 0.495 HD11 ' HE3' ' A' ' 71' ' ' MET . 0.8 OUTLIER -96.99 -28.05 14.34 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.247 -0.433 . . . . 72.35 110.909 179.927 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' M' M ' 32' ' ' LYS . . . . . . . . . . . . . 7.5 tttp -49.2 -46.42 45.67 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.205 -0.452 . . . . 65.45 110.889 179.825 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' M' M ' 33' ' ' HIS . . . . . . . . . . . . . 22.1 t-160 -50.95 -37.18 42.87 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.239 -0.437 . . . . 72.24 110.842 179.91 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' M' M ' 34' ' ' ILE . . . . . . . . . . . . . 47.6 mm -50.33 -39.57 17.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.221 -0.445 . . . . 75.0 111.157 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' M' M ' 35' ' ' VAL . . . . . 0.585 HG11 ' HE3' ' A' ' 72' ' ' MET . 46.9 t -48.86 -40.18 12.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.131 -0.486 . . . . 72.14 111.132 179.818 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' M' M ' 36' ' ' TRP . . . . . . . . . . . . . 23.6 m0 -58.62 -39.91 81.82 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.177 -0.465 . . . . 74.32 110.956 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' M' M ' 37' ' ' ALA . . . . . 0.996 ' HB3' HD13 ' A' ' 39' ' ' LEU . . . -63.69 -18.66 64.21 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.198 -0.455 . . . . 73.23 111.141 179.845 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' M' M ' 38' ' ' SER . . . . . . . . . . . . . 13.2 m -69.48 -17.95 63.66 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.199 -0.455 . . . . 65.1 110.876 -179.811 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' M' M ' 39' ' ' ARG . . . . . . . . . . . . . 25.8 mmm180 -63.11 -24.18 67.78 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.122 -0.49 . . . . 73.43 110.831 -179.916 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' M' M ' 40' ' ' GLU . . . . . . . . . . . . . 17.3 tt0 -80.72 -48.07 13.07 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.212 -0.449 . . . . 73.4 110.905 -179.946 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' M' M ' 41' ' ' LEU . . . . . 0.655 HD11 ' OG ' ' A' ' 38' ' ' SER . 19.7 mt -52.36 170.3 0.07 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.168 -0.469 . . . . 74.3 110.913 -179.992 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' M' M ' 42' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -67.39 129.87 41.28 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.177 -0.465 . . . . 74.23 110.843 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' M' M ' 43' ' ' ARG . . . . . . . . . . . . . 18.3 ttt180 . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 116.123 -0.489 . . . . 64.31 110.844 -179.923 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 241' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 262' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 301' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 322' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.112 0 CA-C-O 120.764 0.316 . . . . 45.1 111.106 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -108.31 -66.78 1.01 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.22 -0.446 . . . . 72.24 110.899 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 47.3 mt-30 -84.7 176.83 8.31 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.206 -0.452 . . . . 73.35 110.925 -179.941 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.495 HD22 ' HG2' ' A' ' 8' ' ' GLN . 10.8 mt -126.33 151.63 47.31 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.171 -0.468 . . . . 62.43 110.884 -179.976 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 61.6 p -115.86 176.39 5.11 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.165 -0.47 . . . . 73.52 111.201 179.912 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 21.2 tt0 -55.76 -29.22 59.26 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.238 -0.437 . . . . 72.15 110.941 179.986 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -67.17 -37.58 83.96 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.11 -0.495 . . . . 62.03 110.876 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' GLN . . . . . 0.495 ' HG2' HD22 ' A' ' 4' ' ' LEU . 28.5 tp60 -77.84 -42.47 33.52 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.125 -0.489 . . . . 73.12 110.915 -179.913 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 54.3 mt -69.16 -37.25 76.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.205 -0.452 . . . . 60.52 111.114 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -51.95 -39.06 58.65 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.161 -0.472 . . . . 73.34 111.12 179.796 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 56.8 mt-10 -72.64 -52.03 17.06 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.234 -0.439 . . . . 73.42 110.89 -179.917 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.531 ' HB3' HD13 ' A' ' 69' ' ' LEU . 30.4 m-85 -55.96 -39.6 71.99 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.151 -0.477 . . . . 74.32 110.861 -179.913 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.14 -31.35 65.25 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.109 -0.496 . . . . 43.13 110.883 -179.985 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 24.4 tt0 -72.27 -30.71 65.11 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.231 -0.44 . . . . 63.32 110.879 179.966 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -72.77 -35.04 67.35 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.162 -0.472 . . . . 65.23 111.115 179.92 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 91.5 t80 -75.63 -51.99 11.58 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.213 -0.449 . . . . 73.32 110.87 -179.874 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 14.8 t -52.03 -31.79 31.42 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.158 -0.474 . . . . 75.45 110.845 -179.79 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.533 HD23 ' HB3' ' M' ' 38' ' ' SER . 15.9 tp -64.05 -47.11 81.46 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.071 -0.513 . . . . 65.02 110.911 -179.954 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.566 ' CD1' HG11 ' A' ' 35' ' ' VAL . 17.2 m-85 -69.79 -24.82 63.55 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.183 -0.462 . . . . 73.4 110.848 179.972 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 21.2 t0 -86.59 98.58 11.17 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.184 -0.462 . . . . 71.04 110.812 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.763 ' HE2' HG22 ' A' ' 35' ' ' VAL . 5.0 mptp? -71.23 -55.51 7.95 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.166 -0.47 . . . . 62.23 110.85 -179.99 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 23.1 p-10 -71.12 -10.25 59.43 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.249 -0.432 . . . . 71.51 110.833 179.892 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 51.49 40.6 47.21 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.746 -0.74 . . . . 54.22 112.522 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 21.1 p-10 -88.31 -15.7 35.04 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.878 0.37 . . . . 74.32 110.909 -179.977 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 104.64 -11.69 50.17 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.72 -0.752 . . . . 73.23 112.518 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 5.0 p -129.05 130.67 46.86 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.739 0.305 . . . . 44.52 111.182 -179.896 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 24.8 mt -96.83 128.64 47.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.244 -0.434 . . . . 74.51 111.149 179.933 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 32.2 p -108.31 -177.5 3.34 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.159 -0.473 . . . . 73.51 111.187 179.945 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.41 ' HB ' HD13 ' A' ' 48' ' ' LEU . 39.2 p -64.6 -37.32 87.15 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.259 -0.428 . . . . 73.35 111.141 -179.958 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 6.0 mmmm -71.99 -49.92 33.12 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.176 -0.466 . . . . 63.13 110.894 179.891 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 68.8 mt-10 -60.47 -36.61 78.67 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.212 -0.449 . . . . 75.44 110.879 179.985 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.2 tt -74.28 -55.63 5.81 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.131 -0.486 . . . . 75.34 110.931 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -52.08 -28.03 24.4 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.76 -0.734 . . . . 24.1 112.479 179.878 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 95.8 m -65.76 -54.51 26.14 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.767 0.318 . . . . 60.14 111.146 -179.889 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.763 HG22 ' HE2' ' A' ' 21' ' ' LYS . 42.7 t -55.98 -50.22 70.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.275 -0.421 . . . . 71.55 111.107 179.926 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -51.99 -38.06 55.37 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.177 -0.465 . . . . 64.12 110.853 179.915 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 32.7 ttm-85 -53.5 -52.89 58.12 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.277 -0.42 . . . . 74.44 110.872 -179.903 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' SER . . . . . 0.59 ' OG ' HD21 ' M' ' 41' ' ' LEU . 3.1 t -64.76 -26.56 68.41 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.199 -0.455 . . . . 54.2 110.864 -179.826 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.98 HD13 ' HB3' ' M' ' 37' ' ' ALA . 61.9 mt -79.45 -18.6 51.78 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.152 -0.477 . . . . 72.03 110.958 -179.994 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 101.45 28.24 6.83 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.746 -0.74 . . . . 53.53 112.458 179.88 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 48.4 mm-40 -125.09 129.88 51.12 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.819 0.342 . . . . 60.11 110.908 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 39.2 t30 -109.86 80.02 1.61 Allowed Pre-proline 0 C--N 1.33 -0.28 0 CA-C-O 121.602 0.715 . . . . 72.32 110.896 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.7 147.94 64.37 Favored 'Trans proline' 0 C--O 1.231 0.174 0 C-N-CA 122.724 2.283 . . . . 75.0 112.346 179.913 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 21.3 p -96.01 162.56 13.5 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.209 -0.45 . . . . 72.54 111.189 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 20.7 tt0 -55.28 -44.39 75.61 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.26 -0.427 . . . . 74.43 110.846 -179.951 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.25 -31.73 64.28 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.186 -0.461 . . . . 53.04 111.094 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 78.4 tt0 -66.46 -49.29 67.16 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.246 -0.434 . . . . 75.1 110.92 -179.95 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.41 HD13 ' HB ' ' A' ' 29' ' ' THR . 14.8 mt -55.15 -51.68 65.7 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.158 -0.474 . . . . 70.02 110.95 -179.991 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 15.9 tp60 -55.01 -28.93 55.84 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.196 -0.456 . . . . 65.44 110.933 179.92 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -72.89 -40.05 65.9 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.182 -0.463 . . . . 73.22 110.825 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 38.2 mtp -76.36 -25.26 54.46 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.206 -0.452 . . . . 61.54 110.868 -179.995 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 80.3 mt -79.67 -40.64 21.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.259 -0.428 . . . . 72.42 111.14 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 49.2 m-20 -60.16 -48.8 80.21 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.178 -0.464 . . . . 62.01 110.905 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 18.0 pt-20 -55.7 -27.07 48.36 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.121 -0.49 . . . . 62.4 110.911 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.584 HG11 HD23 ' M' ' 31' ' ' LEU . 32.4 m -108.34 11.71 8.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.151 -0.477 . . . . 63.1 111.166 179.955 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 26.9 t0 -90.03 98.13 11.59 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.149 -0.478 . . . . 45.42 110.863 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.28 -46.25 9.37 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.206 -0.452 . . . . 63.02 111.13 179.931 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 10.2 p-10 -81.66 -0.19 41.49 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.196 -0.456 . . . . 75.02 110.863 179.96 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 53.65 56.5 19.93 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.718 -0.753 . . . . 53.23 112.508 -179.928 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 49.6 p-10 -114.51 -15.82 11.98 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.845 0.355 . . . . 73.43 110.861 -179.857 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 91.93 17.41 47.9 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.755 -0.736 . . . . 72.34 112.477 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 20.4 p -145.54 168.37 20.76 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.793 0.33 . . . . 73.43 111.11 -179.876 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 16.9 mt -106.72 109.49 28.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.163 -0.471 . . . . 60.11 111.133 179.927 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -76.9 -172.97 2.5 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.167 -0.469 . . . . 70.34 110.852 179.864 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.535 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 2.5 t80 -65.58 -58.43 11.77 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-O 121.667 0.746 . . . . 73.15 110.92 -179.936 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' PRO . . . . . 0.535 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 54.2 Cg_endo -69.75 -24.98 29.11 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.658 2.239 . . . . 73.12 112.365 179.949 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 22.7 mt-10 -63.66 -40.67 97.41 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.237 -0.438 . . . . 63.5 110.914 -179.996 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 34.3 t80 -74.02 -36.28 64.45 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.161 -0.472 . . . . 64.31 110.883 -179.945 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.531 HD13 ' HB3' ' A' ' 12' ' ' PHE . 50.1 tp -70.64 -53.9 14.03 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.171 -0.468 . . . . 72.02 110.949 179.981 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 13.1 t -55.64 -26.55 45.01 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.178 -0.465 . . . . 73.55 111.126 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 9.1 tmm? -62.83 -39.61 94.84 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.197 -0.456 . . . . 64.12 110.892 179.913 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -79.76 -40.02 29.7 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.22 -0.445 . . . . 72.31 110.938 179.918 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -66.75 -34.86 78.77 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.184 -0.462 . . . . 74.24 111.085 179.9 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 15.2 ttp180 -58.41 -24.64 60.65 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.217 -0.447 . . . . 60.33 110.856 -179.847 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 39.7 tttm -74.8 -6.5 49.34 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.218 -0.446 . . . . 74.32 110.927 179.924 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 18.5 ptm -51.3 -30.83 19.4 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.179 -0.464 . . . . 72.53 110.916 179.848 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 3.3 tppp? -174.7 -74.82 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.192 -0.458 . . . . 64.03 110.838 179.931 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 36.5 t70 -71.7 113.6 8.91 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.245 -0.434 . . . . 71.04 110.889 179.87 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' THR . . . . . 0.58 HG23 ' H ' ' M' ' 27' ' ' LYS . 10.4 t -166.41 28.15 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.199 -0.455 . . . . 53.22 111.12 -179.893 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -125.56 8.02 7.64 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.235 -0.439 . . . . 73.52 110.866 179.952 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' SER . . . . . 0.624 ' O ' HD12 ' A' ' 85' ' ' ILE . 33.7 p -77.86 -52.58 8.66 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.167 -0.47 . . . . 74.24 110.86 -179.74 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 11.8 mm-40 -72.18 -42.08 66.26 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.122 -0.49 . . . . 75.33 110.868 -179.948 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -53.47 -28.41 30.43 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.177 -0.465 . . . . 73.43 110.89 -179.928 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 2.9 tm-20 -69.88 -50.94 37.49 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.127 -0.488 . . . . 74.14 110.914 -179.906 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.753 HG21 HG22 ' A' ' 142' ' ' VAL . 3.1 mp -70.43 -50.97 41.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.13 -0.486 . . . . 70.31 111.148 179.95 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 41.8 ttm-85 -54.69 -28.15 45.58 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.151 -0.477 . . . . 74.01 110.885 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.726 ' O ' HG23 ' A' ' 91' ' ' VAL . 7.9 tm-20 -74.94 -58.52 3.23 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.177 -0.465 . . . . 71.4 110.866 -179.948 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 88' ' ' ALA . . . . . 0.74 ' HB1' ' CE2' ' A' ' 92' ' ' PHE . . . -58.83 -43.31 90.63 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.177 -0.465 . . . . 64.23 111.129 179.922 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 4.1 t80 -52.01 -48.11 64.63 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.166 -0.47 . . . . 64.54 110.925 -179.947 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.22 -26.19 64.68 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.13 -0.486 . . . . 72.3 110.905 -179.95 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 91' ' ' VAL . . . . . 0.726 HG23 ' O ' ' A' ' 87' ' ' GLU . 93.0 t -77.36 -27.31 15.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.16 -0.473 . . . . 61.22 111.133 179.974 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.74 ' CE2' ' HB1' ' A' ' 88' ' ' ALA . 18.2 m-85 -94.77 -28.48 15.25 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.174 -0.466 . . . . 75.54 110.872 -179.946 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 34.6 t0 -66.9 95.86 0.39 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.12 -0.491 . . . . 74.52 110.888 179.981 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 71.1 mmtt -78.73 -52.26 8.63 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.201 -0.454 . . . . 55.14 110.899 179.997 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 10.2 p30 -72.32 -9.2 58.18 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.193 -0.458 . . . . 74.3 110.838 179.886 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 59.19 26.22 61.07 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.733 -0.746 . . . . 72.2 112.518 -179.923 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 35.7 p-10 -81.75 -16.16 51.99 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.91 0.386 . . . . 74.34 110.895 -179.878 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 87.05 18.71 57.34 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.742 -0.742 . . . . 70.4 112.506 -179.968 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 19.7 m-85 -141.96 146.55 35.76 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.834 0.349 . . . . 72.21 110.948 -179.791 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.556 HD12 ' CD2' ' A' ' 141' ' ' PHE . 62.1 mt -112.89 127.47 70.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.108 -0.496 . . . . 74.03 111.178 179.87 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 96.3 p -112.75 -172.59 2.08 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.163 -0.471 . . . . 73.44 110.835 -179.876 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 102' ' ' ALA . . . . . 0.472 ' O ' HG11 ' A' ' 121' ' ' VAL . . . -65.4 -34.14 77.61 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.129 -0.487 . . . . 70.31 111.095 179.914 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -70.4 -49.89 44.27 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.213 -0.449 . . . . 53.44 111.064 179.934 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 104' ' ' GLU . . . . . 0.53 ' O ' HG23 ' A' ' 108' ' ' VAL . 21.5 mt-10 -62.24 -50.21 72.67 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.243 -0.435 . . . . 73.12 110.853 -179.875 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.456 HD21 ' HB3' ' A' ' 124' ' ' MET . 12.0 tp -53.6 -52.46 59.73 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.151 -0.477 . . . . 62.24 110.946 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 106' ' ' ARG . . . . . 0.489 ' HB2' HG21 ' A' ' 121' ' ' VAL . 31.9 ttp180 -57.34 -42.29 81.69 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.158 -0.474 . . . . 64.23 110.855 179.949 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 50.3 t60 -60.34 -34.42 73.81 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.249 -0.432 . . . . 62.32 110.903 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.53 HG23 ' O ' ' A' ' 104' ' ' GLU . 95.8 t -71.53 -52.47 25.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.188 -0.46 . . . . 61.14 111.087 179.996 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 109' ' ' MET . . . . . 0.688 ' HE3' ' HB3' ' M' ' 15' ' ' LYS . 5.6 tpp -62.69 -42.03 99.42 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.174 -0.467 . . . . 63.34 110.882 179.929 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 110' ' ' THR . . . . . 0.452 HG23 ' O ' ' A' ' 106' ' ' ARG . 12.8 p -53.84 -36.62 62.77 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.255 -0.429 . . . . 63.12 111.138 -179.933 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 87.9 m-20 -61.13 -30.24 70.25 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.248 -0.433 . . . . 64.13 110.893 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.745 HD13 ' HD3' ' M' ' 18' ' ' LYS . 23.5 mt -70.75 -23.38 62.42 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.168 -0.469 . . . . 72.44 110.914 179.988 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 101.02 32.98 5.12 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.77 -0.729 . . . . 54.5 112.509 179.901 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 34.9 tp10 -111.65 111.02 21.72 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.934 0.397 . . . . 71.41 110.922 -179.905 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 5.8 ptpp? -60.67 127.79 33.41 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.116 -0.493 . . . . 71.42 110.845 -179.985 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.468 HD21 ' HD3' ' M' ' 15' ' ' LYS . 30.5 mt -146.75 162.5 38.42 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.235 -0.438 . . . . 74.01 110.928 179.895 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 33.1 p -118.68 159.87 22.87 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.167 -0.47 . . . . 74.54 111.177 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -52.24 -39.58 60.49 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.217 -0.447 . . . . 71.34 110.857 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -72.48 -33.37 66.94 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.187 -0.46 . . . . 70.33 110.877 -179.893 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 65.4 tt0 -66.34 -39.21 89.05 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.15 -0.477 . . . . 71.33 110.888 -179.944 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.489 HG21 ' HB2' ' A' ' 106' ' ' ARG . 89.4 t -62.62 -34.24 64.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.158 -0.474 . . . . 73.31 111.133 179.982 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -51.97 -45.34 64.4 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.205 -0.452 . . . . 70.04 110.854 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 17.9 tp10 -56.62 -29.34 62.08 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.21 -0.45 . . . . 74.25 110.893 -179.915 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 124' ' ' MET . . . . . 0.474 ' HE1' ' HB2' ' M' ' 15' ' ' LYS . 8.7 mtp -74.46 -56.98 4.24 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.178 -0.464 . . . . 73.32 110.923 179.971 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 34.7 mm -54.05 -35.57 29.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.23 -0.441 . . . . 75.11 111.097 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 16.3 tpt180 -65.85 -31.75 72.88 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.203 -0.453 . . . . 73.4 110.869 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -71.33 -48.82 48.0 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.196 -0.456 . . . . 74.04 110.903 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.646 ' HB3' HG22 ' A' ' 136' ' ' VAL . . . -71.75 -34.2 69.31 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.165 -0.47 . . . . 63.25 111.089 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 49.8 t0 -68.27 86.79 0.28 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.228 -0.442 . . . . 71.43 110.887 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 56.5 mt -79.94 -46.0 22.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.204 -0.453 . . . . 71.13 111.124 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 21.7 p30 -72.7 -8.73 56.8 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.17 -0.468 . . . . 63.51 110.906 179.822 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 62.84 43.38 99.02 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.725 -0.75 . . . . 63.51 112.499 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 34.5 p-10 -88.69 -16.01 33.41 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.818 0.342 . . . . 75.34 110.841 -179.941 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 103.87 2.45 45.96 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.759 -0.734 . . . . 43.52 112.476 -179.928 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 4.5 tt0 -149.2 172.26 15.13 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.82 0.343 . . . . 74.21 110.941 -179.913 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 136' ' ' VAL . . . . . 0.646 HG22 ' HB3' ' A' ' 128' ' ' ALA . 94.4 t -108.21 111.82 37.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.204 -0.453 . . . . 72.23 111.082 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 15.5 p30 -91.85 179.63 5.56 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.155 -0.475 . . . . 74.11 110.917 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 138' ' ' TYR . . . . . 0.694 ' O ' HG23 ' A' ' 142' ' ' VAL . 36.1 t80 -63.97 -47.65 79.57 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.194 -0.457 . . . . 75.12 110.927 -179.943 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 14.3 tt0 -52.04 -39.86 60.21 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.139 -0.482 . . . . 62.24 110.867 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -78.49 -42.46 29.62 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.221 -0.445 . . . . 63.45 110.898 -179.946 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 141' ' ' PHE . . . . . 0.556 ' CD2' HD12 ' A' ' 100' ' ' ILE . 24.4 t80 -58.93 -36.7 75.2 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.15 -0.477 . . . . 72.44 110.859 -179.959 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 142' ' ' VAL . . . . . 0.753 HG22 HG21 ' A' ' 85' ' ' ILE . 94.0 t -66.66 -44.85 89.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.184 -0.462 . . . . 70.1 111.119 179.995 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 31.1 tt0 -66.54 -42.94 86.41 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.207 -0.451 . . . . 75.32 110.91 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 33.6 tpp -65.11 -26.75 68.34 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.216 -0.447 . . . . 73.23 110.868 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 145' ' ' MET . . . . . 0.407 ' HE1' HG22 ' M' ' 19' ' ' ILE . 0.0 OUTLIER -84.37 -28.16 27.17 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.232 -0.44 . . . . 60.32 110.832 179.973 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 1.6 m -104.63 21.31 17.05 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.275 -0.42 . . . . 72.11 111.092 -179.886 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -67.79 102.11 1.18 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.229 -0.441 . . . . 72.23 111.088 179.896 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 18.6 mtpp . . . . . 0 C--N 1.328 -0.329 0 CA-C-N 116.239 -0.437 . . . . 75.32 110.947 179.94 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' M' M ' 8' ' ' LEU . . . . . . . . . . . . . 4.6 mm? . . . . . 0 C--O 1.231 0.08 0 CA-C-O 120.843 0.354 . . . . 73.04 110.896 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' M' M ' 9' ' ' SER . . . . . . . . . . . . . 8.3 t -145.66 -42.43 0.22 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.143 -0.48 . . . . 64.31 110.868 -179.945 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' M' M ' 10' ' ' GLY . . . . . . . . . . . . . . . -132.91 142.19 13.67 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.741 -0.742 . . . . 64.52 112.494 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' M' M ' 11' ' ' GLY . . . . . . . . . . . . . . . 168.1 -43.67 0.23 Allowed Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.731 -0.747 . . . . 63.24 112.447 -179.878 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' M' M ' 12' ' ' GLU . . . . . . . . . . . . . 15.8 mt-10 -66.27 115.74 6.57 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.926 0.393 . . . . 64.13 110.888 -179.872 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' M' M ' 13' ' ' LEU . . . . . 0.668 HD23 ' N ' ' M' ' 14' ' ' ASP . 2.7 tt -88.18 145.02 26.12 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.137 -0.483 . . . . 74.13 110.919 -179.969 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' M' M ' 14' ' ' ASP . . . . . 0.668 ' N ' HD23 ' M' ' 13' ' ' LEU . 8.7 t70 -51.3 -62.77 1.42 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.197 -0.456 . . . . 75.14 110.872 179.864 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' M' M ' 15' ' ' LYS . . . . . 0.688 ' HB3' ' HE3' ' A' ' 109' ' ' MET . 11.3 mttm -50.61 -49.72 55.89 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.207 -0.451 . . . . 75.52 110.871 179.99 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' M' M ' 16' ' ' TRP . . . . . 0.727 ' CE3' HD12 ' M' ' 19' ' ' ILE . 5.6 m95 -52.27 -42.97 64.15 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.231 -0.441 . . . . 75.32 110.909 179.921 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' M' M ' 17' ' ' GLU . . . . . . . . . . . . . 48.3 tt0 -58.37 -28.08 64.8 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.224 -0.443 . . . . 61.51 110.902 -179.942 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' M' M ' 18' ' ' LYS . . . . . 0.745 ' HD3' HD13 ' A' ' 112' ' ' LEU . 14.2 ttmm -68.36 -25.85 65.29 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.146 -0.479 . . . . 53.41 110.892 179.948 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' M' M ' 19' ' ' ILE . . . . . 0.727 HD12 ' CE3' ' M' ' 16' ' ' TRP . 33.5 mt -86.46 -13.2 10.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.23 -0.441 . . . . 64.31 111.131 179.865 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' M' M ' 20' ' ' ARG . . . . . . . . . . . . . 39.7 ttp180 -66.28 -39.66 89.56 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.178 -0.465 . . . . 70.22 110.897 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' M' M ' 21' ' ' LEU . . . . . . . . . . . . . 16.0 mt 53.63 -169.94 0.05 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.209 -0.451 . . . . 54.21 110.91 -180.0 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' M' M ' 22' ' ' ARG . . . . . . . . . . . . . 24.6 mtp85 -156.5 57.57 1.46 Allowed Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 121.629 0.728 . . . . 72.54 110.836 179.931 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' M' M ' 23' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.79 -171.1 0.44 Allowed 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.716 2.278 . . . . 72.53 112.376 179.961 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' M' M ' 24' ' ' GLY . . . . . . . . . . . . . . . -144.1 -109.96 0.7 Allowed Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.744 -0.741 . . . . 60.44 112.479 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' M' M ' 25' ' ' GLY . . . . . . . . . . . . . . . 81.22 -84.77 1.43 Allowed Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.726 -0.749 . . . . 53.25 112.457 -179.937 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' M' M ' 26' ' ' LYS . . . . . . . . . . . . . 13.8 ttpt 63.57 160.0 0.09 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.827 0.346 . . . . 61.11 110.921 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' M' M ' 27' ' ' LYS . . . . . 0.58 ' H ' HG23 ' A' ' 79' ' ' THR . 30.6 mmtp 58.46 -169.62 0.12 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.257 -0.429 . . . . 60.23 110.922 179.889 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' M' M ' 28' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER 63.69 106.17 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.244 -0.435 . . . . 70.34 110.936 179.954 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' M' M ' 29' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -113.52 -22.3 10.39 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.236 -0.438 . . . . 74.42 110.908 -179.865 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' M' M ' 30' ' ' LYS . . . . . . . . . . . . . 17.4 tttm 63.67 29.19 15.06 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.121 -0.491 . . . . 73.54 110.862 179.893 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' M' M ' 31' ' ' LEU . . . . . 0.584 HD23 HG11 ' A' ' 55' ' ' VAL . 10.1 tp -144.94 -52.16 0.28 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.256 -0.429 . . . . 62.42 110.934 179.941 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' M' M ' 32' ' ' LYS . . . . . . . . . . . . . 3.2 ptmm? -49.53 -36.18 22.63 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.188 -0.46 . . . . 75.52 110.9 179.824 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' M' M ' 33' ' ' HIS . . . . . . . . . . . . . 12.7 t-160 -49.74 -42.61 46.66 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.201 -0.454 . . . . 73.4 110.861 179.898 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' M' M ' 34' ' ' ILE . . . . . . . . . . . . . 55.1 mt -50.69 -38.69 17.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.201 -0.454 . . . . 73.41 111.145 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' M' M ' 35' ' ' VAL . . . . . . . . . . . . . 39.9 t -49.6 -39.54 14.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.139 -0.482 . . . . 75.12 111.166 179.859 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' M' M ' 36' ' ' TRP . . . . . . . . . . . . . 21.9 m0 -58.94 -39.29 81.18 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.196 -0.456 . . . . 71.24 110.926 179.966 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' M' M ' 37' ' ' ALA . . . . . 0.98 ' HB3' HD13 ' A' ' 39' ' ' LEU . . . -63.82 -18.64 64.33 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.226 -0.443 . . . . 52.02 111.091 179.88 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' M' M ' 38' ' ' SER . . . . . 0.533 ' HB3' HD23 ' A' ' 18' ' ' LEU . 0.9 OUTLIER -71.88 -17.96 62.08 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.193 -0.458 . . . . 75.42 110.843 -179.787 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' M' M ' 39' ' ' ARG . . . . . . . . . . . . . 60.1 mtt180 -56.48 -25.83 52.32 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.201 -0.454 . . . . 74.11 110.894 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' M' M ' 40' ' ' GLU . . . . . . . . . . . . . 22.7 tt0 -87.43 -47.99 8.33 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.205 -0.452 . . . . 75.2 110.905 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' M' M ' 41' ' ' LEU . . . . . 0.59 HD21 ' OG ' ' A' ' 38' ' ' SER . 11.7 mt -64.49 153.66 38.24 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.179 -0.464 . . . . 73.02 110.957 -179.993 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' M' M ' 42' ' ' GLU . . . . . . . . . . . . . 15.1 tp10 -103.85 -57.83 1.97 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.193 -0.458 . . . . 75.43 110.916 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' M' M ' 43' ' ' ARG . . . . . . . . . . . . . 47.7 ttt-85 . . . . . 0 C--N 1.329 -0.289 0 CA-C-N 116.133 -0.485 . . . . 65.34 110.892 -179.955 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 241' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 262' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 301' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 322' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.789 0.328 . . . . 54.23 111.108 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -126.21 158.86 34.55 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.231 -0.441 . . . . 54.32 110.899 179.93 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 32.8 mt-30 -67.5 -74.03 0.13 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.181 -0.463 . . . . 71.42 110.92 -179.914 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 11.2 mt -126.03 150.6 47.99 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.213 -0.449 . . . . 72.31 110.878 -179.984 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 17.3 p -119.12 171.73 8.07 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.139 -0.482 . . . . 64.45 111.152 179.911 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -55.44 -32.03 62.41 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.22 -0.445 . . . . 61.42 110.866 -179.971 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -66.97 -37.19 83.8 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.162 -0.472 . . . . 64.22 110.925 -179.959 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 7.0 tp60 -78.1 -41.45 35.19 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.127 -0.488 . . . . 74.03 110.898 -179.923 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 78.3 mt -69.35 -40.61 80.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.195 -0.457 . . . . 63.32 111.147 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -53.21 -31.4 42.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.133 -0.485 . . . . 63.54 111.105 179.787 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -74.12 -39.36 63.4 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.225 -0.443 . . . . 73.12 110.913 -179.924 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 24.7 m-85 -72.25 -45.89 58.28 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.189 -0.459 . . . . 72.24 110.918 -179.954 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 24.2 ttpp -67.45 -26.75 66.55 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.148 -0.478 . . . . 71.24 110.88 179.958 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -67.02 -38.64 86.29 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.256 -0.429 . . . . 75.12 110.866 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -64.01 -34.06 77.15 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.122 -0.49 . . . . 73.03 111.121 179.887 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 51.7 t80 -57.3 -53.87 53.18 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.224 -0.444 . . . . 65.2 110.832 -179.895 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.7 t -52.6 -29.66 27.08 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.175 -0.466 . . . . 54.53 110.843 -179.785 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 15.6 tp -67.12 -48.17 68.9 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.141 -0.481 . . . . 61.14 110.91 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 44.5 m-85 -71.78 -25.34 61.98 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.227 -0.442 . . . . 75.32 110.886 179.922 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 8.1 t0 -82.54 98.56 9.02 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.139 -0.482 . . . . 73.13 110.903 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.637 ' HE3' HG21 ' A' ' 34' ' ' THR . 21.7 ttmm -69.21 -53.46 19.84 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.206 -0.452 . . . . 61.34 110.888 179.999 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 9.7 p30 -76.78 -10.09 59.13 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.24 -0.436 . . . . 34.21 110.833 179.915 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 52.15 46.49 56.47 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.701 -0.761 . . . . 53.54 112.501 -179.942 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 38.4 p-10 -89.08 -12.47 41.11 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.845 0.355 . . . . 75.22 110.853 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 105.44 -11.69 47.18 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.72 -0.752 . . . . 64.32 112.477 -179.965 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 56.0 p -133.59 130.69 38.71 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.788 0.328 . . . . 72.41 111.125 -179.827 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.529 HD12 ' HB ' ' A' ' 63' ' ' ILE . 47.3 mt -84.45 125.7 40.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.193 -0.458 . . . . 75.44 111.123 179.908 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.434 HG22 ' CG2' ' A' ' 62' ' ' THR . 28.3 p -107.81 171.09 7.59 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.158 -0.474 . . . . 62.53 111.109 179.989 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 16.3 p -54.21 -45.02 72.14 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.158 -0.474 . . . . 75.11 111.187 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 4.9 tmtm? -60.14 -37.3 79.67 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.177 -0.465 . . . . 74.04 110.911 179.91 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.474 ' O ' HG23 ' A' ' 35' ' ' VAL . 39.4 mt-10 -74.0 -32.86 63.59 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.265 -0.425 . . . . 73.22 110.89 179.939 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.586 HD13 ' O ' ' A' ' 32' ' ' LEU . 0.9 OUTLIER -74.28 -39.98 62.59 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.169 -0.469 . . . . 73.42 110.892 -179.967 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -71.58 -38.03 61.78 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.735 -0.745 . . . . 52.51 112.537 179.87 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.637 HG21 ' HE3' ' A' ' 21' ' ' LYS . 96.1 m -62.79 -55.96 21.75 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.817 0.341 . . . . 72.42 111.185 -179.899 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.474 HG23 ' O ' ' A' ' 31' ' ' GLU . 71.4 t -54.63 -51.79 47.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.208 -0.451 . . . . 62.31 111.13 179.875 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 26.4 mtp -52.08 -31.51 30.71 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.205 -0.452 . . . . 71.34 110.884 179.91 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 45.4 ttp180 -63.37 -43.92 96.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.245 -0.434 . . . . 74.53 110.865 -179.912 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' SER . . . . . 0.619 ' OG ' HD11 ' M' ' 41' ' ' LEU . 1.3 p -65.25 -34.22 77.85 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.163 -0.472 . . . . 51.55 110.85 -179.779 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.941 HD13 ' HB3' ' M' ' 37' ' ' ALA . 32.1 mt -72.11 -19.84 61.73 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.176 -0.465 . . . . 74.32 110.892 179.971 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 101.46 30.07 6.05 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.772 -0.728 . . . . 73.2 112.52 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 83.9 mm-40 -118.64 132.59 56.18 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.798 0.332 . . . . 55.3 110.928 -179.93 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 33.5 t-20 -109.88 76.63 0.98 Allowed Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.618 0.723 . . . . 64.43 110.864 -179.9 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.422 ' CG ' HD21 ' A' ' 48' ' ' LEU . 53.6 Cg_endo -69.73 164.65 33.73 Favored 'Trans proline' 0 C--N 1.341 0.17 0 C-N-CA 122.69 2.26 . . . . 73.23 112.36 179.94 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 19.6 p -112.93 166.41 11.42 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.211 -0.45 . . . . 65.11 111.172 179.983 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -59.17 -42.26 90.4 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.229 -0.441 . . . . 75.15 110.891 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.23 -31.58 64.23 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.153 -0.476 . . . . 44.43 111.079 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -71.88 -52.1 19.01 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.212 -0.449 . . . . 61.35 110.893 -179.92 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.422 HD21 ' CG ' ' A' ' 43' ' ' PRO . 18.8 mt -56.09 -51.78 66.64 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.16 -0.473 . . . . 74.44 110.953 179.985 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 28.6 tp60 -52.85 -29.19 26.52 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.174 -0.466 . . . . 62.43 110.935 179.931 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -75.5 -43.4 49.32 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.213 -0.449 . . . . 72.24 110.892 179.915 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' MET . . . . . 0.437 ' HE1' HD13 ' M' ' 31' ' ' LEU . 68.2 mtp -58.31 -58.04 10.26 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.149 -0.478 . . . . 74.04 110.891 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 79.6 mt -55.89 -42.06 69.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.19 -0.459 . . . . 63.34 111.115 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 63.4 m-20 -60.51 -31.28 70.34 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.15 -0.477 . . . . 73.21 110.877 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -71.26 -23.29 61.95 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.196 -0.456 . . . . 75.01 110.912 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.56 HG13 ' CE1' ' M' ' 29' ' ' TYR . 2.9 m -114.0 10.87 8.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.15 -0.477 . . . . 34.51 111.135 179.973 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 23.2 t0 -90.16 97.67 11.32 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.156 -0.475 . . . . 72.34 110.868 179.943 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.29 -44.27 10.94 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.247 -0.433 . . . . 60.22 111.106 179.946 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 6.4 p-10 -83.09 -0.22 48.07 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.205 -0.452 . . . . 73.03 110.865 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 51.6 57.38 12.29 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.712 -0.756 . . . . 62.2 112.485 -179.952 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 53.1 p-10 -114.56 -15.72 11.97 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.853 0.359 . . . . 55.32 110.845 -179.848 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 89.28 17.81 54.62 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.771 -0.728 . . . . 72.23 112.459 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' THR . . . . . 0.434 ' CG2' HG22 ' A' ' 28' ' ' THR . 28.5 p -150.15 158.67 44.4 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.74 0.305 . . . . 75.53 111.145 -179.868 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.529 ' HB ' HD12 ' A' ' 27' ' ' ILE . 7.6 mm -94.6 110.12 23.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.267 -0.424 . . . . 71.55 111.14 179.924 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -77.47 -172.79 2.65 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.151 -0.477 . . . . 75.35 110.837 179.9 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.537 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 2.5 t80 -64.59 -58.31 13.92 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.621 0.724 . . . . 73.32 110.852 -179.942 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 66' ' ' PRO . . . . . 0.537 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 54.2 Cg_endo -69.76 -29.9 23.13 Favored 'Trans proline' 0 N--CA 1.465 -0.159 0 C-N-CA 122.698 2.265 . . . . 63.41 112.372 -179.981 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 11.5 mt-10 -57.17 -41.63 79.63 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.177 -0.465 . . . . 73.45 110.865 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 5.7 t80 -72.77 -36.12 67.58 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.166 -0.47 . . . . 72.1 110.845 -179.898 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 19.2 tp -65.42 -53.76 38.33 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.139 -0.482 . . . . 74.52 110.91 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 9.4 t -55.24 -28.38 52.83 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.212 -0.449 . . . . 53.2 111.157 179.944 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 6.2 tmm? -68.12 -40.07 82.58 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.181 -0.463 . . . . 52.22 110.897 179.911 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' MET . . . . . 0.471 ' HE2' HG11 ' M' ' 35' ' ' VAL . 0.0 OUTLIER -79.85 -33.57 40.06 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.194 -0.457 . . . . 65.22 110.861 179.967 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -74.91 -33.68 62.05 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.22 -0.446 . . . . 63.31 111.075 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 6.1 ttt85 -60.54 -20.26 59.73 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.215 -0.448 . . . . 71.21 110.939 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 20.7 ttpp -51.59 -30.11 19.86 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.161 -0.472 . . . . 71.04 110.86 179.985 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 7.2 ttm -53.3 -54.54 34.91 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.257 -0.429 . . . . 65.5 110.855 179.917 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -157.48 164.03 37.84 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.226 -0.443 . . . . 61.11 110.91 179.952 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 26.5 t0 63.25 75.92 0.38 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.244 -0.435 . . . . 64.34 110.863 179.825 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' THR . . . . . 0.646 HG23 ' HG2' ' M' ' 27' ' ' LYS . 2.0 t 179.23 73.04 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.18 -0.464 . . . . 71.42 111.152 -179.842 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -179.18 -41.56 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.242 -0.435 . . . . 70.35 110.857 179.958 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 1.9 t -52.1 -47.19 65.38 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.177 -0.465 . . . . 72.01 110.904 -179.78 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -52.04 -59.92 3.8 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.128 -0.487 . . . . 73.12 110.914 -179.961 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 14.3 tp10 -58.68 -35.72 73.05 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.145 -0.48 . . . . 72.01 110.929 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 13.2 tp10 -61.35 -39.76 91.78 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.109 -0.496 . . . . 75.42 110.896 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.512 HD13 HG13 ' A' ' 142' ' ' VAL . 53.2 mt -75.03 -49.49 28.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.158 -0.473 . . . . 52.42 111.134 179.971 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 12.2 ttt180 -62.21 -28.33 69.61 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.146 -0.479 . . . . 63.4 110.858 179.977 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.731 ' O ' HG23 ' A' ' 91' ' ' VAL . 11.3 mm-40 -70.21 -58.38 3.84 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.221 -0.445 . . . . 75.41 110.91 -179.976 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 88' ' ' ALA . . . . . 0.621 ' HB1' ' CE2' ' A' ' 92' ' ' PHE . . . -54.29 -45.39 72.5 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.095 -0.502 . . . . 42.15 111.107 179.916 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 6.7 t80 -52.06 -51.33 58.24 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.211 -0.449 . . . . 74.23 110.909 -179.935 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 13.2 ttt85 -61.68 -40.52 95.26 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.121 -0.49 . . . . 70.1 110.869 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 91' ' ' VAL . . . . . 0.731 HG23 ' O ' ' A' ' 87' ' ' GLU . 39.0 t -59.45 -51.15 76.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.214 -0.448 . . . . 75.21 111.137 179.99 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.621 ' CE2' ' HB1' ' A' ' 88' ' ' ALA . 11.8 m-85 -68.56 -29.04 67.51 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.159 -0.473 . . . . 73.32 110.838 -179.972 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 33.1 t0 -70.45 94.09 0.94 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.158 -0.473 . . . . 62.01 110.881 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 2.6 mptm? -78.67 -52.09 8.92 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.215 -0.448 . . . . 75.42 110.869 -179.962 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 47.6 p30 -72.5 -9.17 58.23 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.219 -0.446 . . . . 64.21 110.895 179.86 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 59.95 28.71 66.54 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.7 -0.762 . . . . 64.11 112.521 -179.924 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 45.3 p-10 -82.39 -16.25 49.77 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.882 0.372 . . . . 73.35 110.896 -179.882 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 88.56 18.66 54.49 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.717 -0.754 . . . . 42.31 112.452 179.991 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 13.4 m-85 -136.03 159.41 41.78 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.841 0.353 . . . . 72.45 110.949 -179.827 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.419 HG21 HD13 ' A' ' 105' ' ' LEU . 71.4 mt -122.04 120.84 62.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.119 -0.491 . . . . 74.53 111.159 179.87 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 4.9 p -114.9 175.0 5.69 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.189 -0.46 . . . . 71.41 110.864 -179.905 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -66.15 -25.17 66.84 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.119 -0.491 . . . . 55.03 111.064 179.927 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -71.07 -49.94 39.22 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.228 -0.442 . . . . 75.2 111.125 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -76.97 -48.05 19.11 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.228 -0.442 . . . . 75.33 110.899 -179.965 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.525 HD21 ' CE ' ' A' ' 124' ' ' MET . 19.0 tp -53.14 -40.45 64.27 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.155 -0.475 . . . . 73.13 110.907 -179.957 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 41.6 ttp180 -56.49 -49.43 74.71 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.155 -0.475 . . . . 71.31 110.894 179.938 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 6.2 t60 -54.28 -36.46 63.68 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.171 -0.468 . . . . 73.23 110.818 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 85.7 t -63.53 -51.66 67.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.219 -0.446 . . . . 72.13 111.129 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 109' ' ' MET . . . . . 0.767 ' HE2' HD11 ' M' ' 19' ' ' ILE . 5.4 mmt -60.58 -26.02 66.64 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.239 -0.437 . . . . 75.44 110.866 179.931 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 1.6 m -66.77 -45.2 79.28 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.206 -0.452 . . . . 43.24 111.164 -179.956 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 5.6 t30 -55.29 -30.62 60.52 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.245 -0.434 . . . . 63.24 110.868 179.973 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.742 HD12 ' HA ' ' A' ' 109' ' ' MET . 7.8 mt -75.42 -25.41 57.5 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.227 -0.442 . . . . 71.12 110.945 179.949 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 101.02 32.98 5.12 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.706 -0.759 . . . . 71.34 112.487 179.866 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -124.25 109.96 14.04 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.873 0.368 . . . . 74.31 110.865 -179.8 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 19.2 mmtm -74.76 128.62 36.0 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.143 -0.48 . . . . 61.21 110.904 179.957 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.481 HD22 ' HG2' ' A' ' 120' ' ' GLU . 10.4 mt -133.17 126.69 32.2 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.235 -0.438 . . . . 75.21 110.904 179.954 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 117' ' ' THR . . . . . 0.624 ' O ' HG23 ' A' ' 121' ' ' VAL . 68.6 p -79.3 -175.06 4.48 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.212 -0.449 . . . . 55.01 111.109 179.952 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -59.84 -40.26 87.92 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.18 -0.464 . . . . 71.51 110.865 179.935 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -75.71 -33.39 60.32 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.253 -0.431 . . . . 73.42 110.86 -179.912 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 120' ' ' GLU . . . . . 0.481 ' HG2' HD22 ' A' ' 116' ' ' LEU . 46.8 tt0 -71.98 -38.17 69.74 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.163 -0.471 . . . . 63.22 110.894 -179.931 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.624 HG23 ' O ' ' A' ' 117' ' ' THR . 92.8 t -74.31 -30.55 26.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.181 -0.463 . . . . 75.24 111.109 179.973 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -78.54 -28.29 46.07 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.2 -0.455 . . . . 73.53 110.839 179.961 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 23.0 tp10 -55.52 -49.99 71.16 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.224 -0.444 . . . . 72.4 110.904 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 124' ' ' MET . . . . . 0.525 ' CE ' HD21 ' A' ' 105' ' ' LEU . 13.6 ptm -66.42 -44.12 83.83 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.156 -0.474 . . . . 50.42 110.922 179.953 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 29.3 mm -53.87 -35.38 27.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.175 -0.466 . . . . 75.34 111.138 179.945 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 14.1 ttt85 -67.18 -31.7 72.28 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.187 -0.46 . . . . 75.21 110.867 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 13.1 tp10 -69.14 -45.16 70.8 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.18 -0.464 . . . . 72.33 110.923 -179.975 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.602 ' HB3' HG22 ' A' ' 136' ' ' VAL . . . -77.12 -33.18 56.88 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.154 -0.476 . . . . 63.3 111.091 179.918 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 47.6 t0 -68.9 85.99 0.34 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.258 -0.428 . . . . 72.23 110.836 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 57.0 mt -79.69 -45.55 23.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.218 -0.446 . . . . 72.04 111.135 179.977 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 24.5 p30 -72.87 -8.63 56.46 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.175 -0.466 . . . . 61.34 110.854 179.849 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 62.72 41.91 99.77 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.793 -0.718 . . . . 52.51 112.463 -179.952 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 13.3 p-10 -87.6 -15.84 36.21 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.843 0.354 . . . . 75.23 110.851 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 102.41 4.23 49.99 Favored Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.687 -0.768 . . . . 62.32 112.482 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -149.19 172.18 15.26 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.861 0.362 . . . . 71.42 110.909 -179.873 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 136' ' ' VAL . . . . . 0.602 HG22 ' HB3' ' A' ' 128' ' ' ALA . 99.6 t -110.83 113.75 45.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.185 -0.461 . . . . 63.54 111.128 179.976 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 14.0 p30 -91.02 167.87 12.07 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.132 -0.486 . . . . 72.42 110.885 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 138' ' ' TYR . . . . . 0.594 ' O ' HG23 ' A' ' 142' ' ' VAL . 88.7 t80 -52.08 -47.17 65.32 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.171 -0.468 . . . . 64.55 110.92 -179.909 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 26.1 tp10 -52.53 -51.78 57.95 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.104 -0.498 . . . . 64.2 110.844 -179.983 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 51.7 mt-10 -66.16 -39.88 90.11 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.179 -0.464 . . . . 54.11 110.899 -179.919 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 75.7 t80 -59.45 -49.16 78.86 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.181 -0.463 . . . . 74.12 110.879 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 142' ' ' VAL . . . . . 0.594 HG23 ' O ' ' A' ' 138' ' ' TYR . 91.8 t -56.58 -40.08 66.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.164 -0.471 . . . . 75.43 111.162 179.94 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 6.9 tp-100 -70.01 -28.34 65.42 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.179 -0.464 . . . . 75.25 110.895 179.998 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 9.5 tpt -74.6 -54.03 8.24 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.229 -0.441 . . . . 61.5 110.89 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 145' ' ' MET . . . . . 0.484 ' HE2' ' HA ' ' M' ' 20' ' ' ARG . 7.7 ttm -66.88 -27.17 67.29 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.218 -0.446 . . . . 71.02 110.875 179.942 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 2.3 m -108.75 21.23 17.52 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.233 -0.439 . . . . 54.23 111.139 -179.888 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -60.24 -172.0 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.241 -0.436 . . . . 53.01 111.073 179.883 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.303 0 CA-C-N 116.196 -0.456 . . . . 72.42 110.918 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' M' M ' 8' ' ' LEU . . . . . . . . . . . . . 17.0 mt . . . . . 0 C--O 1.231 0.108 0 CA-C-O 120.796 0.331 . . . . 64.43 110.909 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' M' M ' 9' ' ' SER . . . . . . . . . . . . . 5.4 t -174.4 81.73 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.18 -0.464 . . . . 53.44 110.89 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' M' M ' 10' ' ' GLY . . . . . . . . . . . . . . . -175.54 -148.6 6.91 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.769 -0.729 . . . . 25.25 112.519 -179.944 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' M' M ' 11' ' ' GLY . . . . . . . . . . . . . . . -138.5 22.91 3.0 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.761 -0.733 . . . . 64.24 112.502 -179.935 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' M' M ' 12' ' ' GLU . . . . . . . . . . . . . 28.2 mm-40 -100.7 167.6 10.22 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.873 0.368 . . . . 72.31 110.866 -179.852 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' M' M ' 13' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -87.74 76.23 8.84 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.14 -0.482 . . . . 73.13 110.936 -179.955 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' M' M ' 14' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -102.47 24.32 10.56 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.186 -0.461 . . . . 74.41 110.87 179.873 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' M' M ' 15' ' ' LYS . . . . . . . . . . . . . 24.1 mttp -79.1 -49.9 11.89 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.204 -0.453 . . . . 74.13 110.852 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' M' M ' 16' ' ' TRP . . . . . 0.707 ' CE3' HD12 ' M' ' 19' ' ' ILE . 46.2 m95 -52.77 -40.55 63.26 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.217 -0.447 . . . . 74.11 110.904 179.972 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' M' M ' 17' ' ' GLU . . . . . . . . . . . . . 28.5 tt0 -55.43 -26.28 41.0 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.234 -0.439 . . . . 55.51 110.87 -179.948 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' M' M ' 18' ' ' LYS . . . . . . . . . . . . . 16.2 ttpp -77.65 -28.02 51.16 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.145 -0.48 . . . . 73.32 110.841 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' M' M ' 19' ' ' ILE . . . . . 0.767 HD11 ' HE2' ' A' ' 109' ' ' MET . 60.2 mt -78.3 -29.38 15.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.22 -0.446 . . . . 63.32 111.164 179.894 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' M' M ' 20' ' ' ARG . . . . . 0.484 ' HA ' ' HE2' ' A' ' 145' ' ' MET . 0.2 OUTLIER -54.02 -28.71 40.01 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.157 -0.474 . . . . 63.13 110.906 179.906 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' M' M ' 21' ' ' LEU . . . . . . . . . . . . . 5.0 mt 57.59 -179.99 0.06 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.186 -0.461 . . . . 71.31 110.903 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' M' M ' 22' ' ' ARG . . . . . 0.401 ' N ' ' CD ' ' M' ' 23' ' ' PRO . 25.0 ptt180 -173.48 57.02 0.21 Allowed Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.533 0.682 . . . . 74.43 110.873 179.96 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' M' M ' 23' ' ' PRO . . . . . 0.401 ' CD ' ' N ' ' M' ' 22' ' ' ARG . 53.8 Cg_endo -69.7 174.83 8.88 Favored 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.671 2.248 . . . . 70.43 112.352 179.993 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' M' M ' 24' ' ' GLY . . . . . . . . . . . . . . . -111.89 41.55 2.2 Favored Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.692 -0.766 . . . . 52.13 112.438 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' M' M ' 25' ' ' GLY . . . . . . . . . . . . . . . -69.54 -144.62 0.19 Allowed Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.743 -0.741 . . . . 42.4 112.504 -179.937 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' M' M ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -156.15 -175.99 5.72 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.829 0.347 . . . . 72.4 110.885 -179.94 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' M' M ' 27' ' ' LYS . . . . . 0.646 ' HG2' HG23 ' A' ' 79' ' ' THR . 10.1 mttp -51.76 149.98 4.32 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.203 -0.453 . . . . 72.4 110.893 179.851 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' M' M ' 28' ' ' GLN . . . . . . . . . . . . . 27.8 mm100 -149.59 102.25 3.15 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.248 -0.433 . . . . 75.53 110.959 179.947 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' M' M ' 29' ' ' TYR . . . . . 0.56 ' CE1' HG13 ' A' ' 55' ' ' VAL . 0.2 OUTLIER -113.47 -25.54 8.73 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.237 -0.438 . . . . 64.1 110.953 -179.832 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' M' M ' 30' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 62.88 20.55 12.28 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.083 -0.508 . . . . 74.22 110.905 179.916 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' M' M ' 31' ' ' LEU . . . . . 0.488 HD23 HG11 ' A' ' 55' ' ' VAL . 25.9 tp -141.72 -55.44 0.46 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.258 -0.428 . . . . 72.44 110.897 179.938 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' M' M ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.68 -45.38 48.71 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.183 -0.462 . . . . 55.12 110.909 179.851 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' M' M ' 33' ' ' HIS . . . . . . . . . . . . . 19.0 t-80 -50.36 -36.91 34.42 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.166 -0.47 . . . . 62.13 110.864 179.897 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' M' M ' 34' ' ' ILE . . . . . . . . . . . . . 49.7 mm -49.74 -40.83 16.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.191 -0.459 . . . . 51.14 111.171 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' M' M ' 35' ' ' VAL . . . . . 0.471 HG11 ' HE2' ' A' ' 72' ' ' MET . 65.9 t -49.26 -40.63 13.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.15 -0.477 . . . . 65.03 111.176 179.772 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' M' M ' 36' ' ' TRP . . . . . . . . . . . . . 28.8 m0 -59.31 -38.88 81.35 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.14 -0.482 . . . . 65.42 110.965 179.962 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' M' M ' 37' ' ' ALA . . . . . 0.941 ' HB3' HD13 ' A' ' 39' ' ' LEU . . . -63.9 -18.61 64.37 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.167 -0.47 . . . . 73.0 111.108 179.876 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' M' M ' 38' ' ' SER . . . . . . . . . . . . . 2.5 m -70.61 -17.97 62.89 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.234 -0.439 . . . . 53.42 110.86 -179.82 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' M' M ' 39' ' ' ARG . . . . . . . . . . . . . 16.2 mmm180 -60.13 -26.8 66.54 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.176 -0.466 . . . . 75.13 110.878 -179.932 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' M' M ' 40' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -74.63 -47.76 30.28 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.205 -0.452 . . . . 64.15 110.908 -179.946 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' M' M ' 41' ' ' LEU . . . . . 0.619 HD11 ' OG ' ' A' ' 38' ' ' SER . 15.3 mt -53.31 171.37 0.08 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.17 -0.468 . . . . 62.43 110.92 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' M' M ' 42' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -133.5 27.69 4.04 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.21 -0.45 . . . . 72.44 110.908 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' M' M ' 43' ' ' ARG . . . . . . . . . . . . . 11.4 ttt85 . . . . . 0 C--N 1.329 -0.317 0 CA-C-N 116.093 -0.503 . . . . 72.42 110.886 -179.914 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 241' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 262' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 301' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 322' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.103 0 CA-C-O 120.772 0.32 . . . . 44.41 111.079 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 19.7 m-20 -129.05 51.53 2.04 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.242 -0.436 . . . . 52.43 110.877 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 11.4 tp60 -135.58 115.71 13.33 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.188 -0.46 . . . . 70.14 110.902 -179.888 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.688 HD22 ' HG2' ' A' ' 8' ' ' GLN . 10.5 mt -100.25 164.22 12.05 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.17 -0.468 . . . . 52.4 110.895 -179.96 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 78.5 p -121.67 171.95 8.48 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.198 -0.455 . . . . 43.32 111.144 179.937 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 12.0 tp10 -53.34 -28.66 29.95 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.249 -0.432 . . . . 72.14 110.886 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 8.0 tm-20 -66.79 -39.13 87.66 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.127 -0.488 . . . . 63.11 110.92 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' GLN . . . . . 0.688 ' HG2' HD22 ' A' ' 4' ' ' LEU . 7.5 tp60 -77.75 -41.95 35.8 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.088 -0.506 . . . . 61.44 110.893 -179.936 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 41.4 mt -68.58 -37.09 77.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.209 -0.451 . . . . 74.14 111.12 179.975 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -52.0 -33.16 37.03 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.15 -0.477 . . . . 75.32 111.139 179.815 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 16.2 mm-40 -74.9 -51.87 12.73 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.203 -0.453 . . . . 65.44 110.878 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.562 ' CB ' HD13 ' A' ' 69' ' ' LEU . 64.5 m-85 -58.18 -46.03 86.47 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.191 -0.459 . . . . 73.52 110.888 -179.925 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 19.5 ttmm -54.18 -30.45 49.58 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.159 -0.473 . . . . 75.13 110.886 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -70.84 -30.69 67.18 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.223 -0.444 . . . . 65.21 110.87 179.946 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -67.02 -48.16 69.22 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.16 -0.473 . . . . 65.2 111.083 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 79.2 t80 -56.09 -54.28 46.97 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.2 -0.454 . . . . 63.21 110.891 -179.932 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 20.6 t -58.99 -26.49 64.54 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.174 -0.466 . . . . 53.34 110.88 -179.8 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 1.2 tt -68.75 -37.33 79.31 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.117 -0.492 . . . . 73.14 110.909 -179.999 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.625 ' CD1' HG11 ' A' ' 35' ' ' VAL . 22.3 m-85 -81.33 -39.09 25.65 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.19 -0.459 . . . . 75.43 110.88 179.943 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 26.5 t0 -62.97 98.56 0.13 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.164 -0.471 . . . . 73.55 110.906 179.931 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.14 -56.05 6.24 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.223 -0.444 . . . . 75.13 110.919 179.978 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 2.3 p-10 -70.86 -10.45 59.62 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.212 -0.449 . . . . 70.23 110.859 179.901 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 50.86 66.43 2.47 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.708 -0.758 . . . . 74.02 112.496 -179.93 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 35.3 p-10 -114.47 -15.71 12.02 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.828 0.347 . . . . 51.42 110.848 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 100.53 10.28 44.62 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.755 -0.736 . . . . 75.23 112.457 -179.977 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 51.0 p -151.29 130.7 12.91 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.771 0.319 . . . . 61.4 111.135 -179.865 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.48 HD12 ' HB ' ' A' ' 63' ' ' ILE . 22.5 mt -91.08 121.78 41.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.218 -0.446 . . . . 74.01 111.071 179.952 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.411 ' HA ' HG22 ' A' ' 62' ' ' THR . 30.0 p -107.77 172.82 6.62 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.153 -0.476 . . . . 54.2 111.128 179.932 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.4 HG22 HD12 ' A' ' 52' ' ' ILE . 71.4 p -61.41 -27.55 68.61 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.201 -0.454 . . . . 71.3 111.164 -179.991 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 19.5 mmmt -75.7 -35.19 60.36 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.223 -0.444 . . . . 64.35 110.93 179.909 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 -76.06 -32.66 59.4 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.19 -0.459 . . . . 74.32 110.898 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.651 HD12 ' CD2' ' A' ' 48' ' ' LEU . 1.2 tm? -67.15 -39.79 86.6 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.123 -0.49 . . . . 65.2 110.93 -179.965 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -67.92 -35.51 84.68 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.71 -0.757 . . . . 72.45 112.528 179.849 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 74.6 m -62.81 -55.47 26.11 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.808 0.337 . . . . 54.41 111.158 -179.876 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.625 HG11 ' CD1' ' A' ' 19' ' ' PHE . 92.4 t -65.28 -53.32 41.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.248 -0.433 . . . . 75.35 111.109 179.901 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -51.9 -31.5 28.66 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.179 -0.464 . . . . 72.45 110.884 179.947 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 48.6 ttt180 -65.95 -47.09 75.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.221 -0.445 . . . . 71.2 110.897 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' SER . . . . . 0.629 ' OG ' HD11 ' M' ' 41' ' ' LEU . 1.3 p -63.66 -33.67 76.15 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.159 -0.473 . . . . 65.04 110.888 -179.81 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.948 HD13 ' HB3' ' M' ' 37' ' ' ALA . 57.7 mt -68.09 -22.11 64.93 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.1 -0.5 . . . . 73.02 110.91 -179.979 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 101.43 31.37 5.56 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.729 -0.748 . . . . 74.34 112.505 179.915 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 13.9 mt-30 -128.29 118.62 23.57 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.793 0.33 . . . . 64.01 110.911 -179.896 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 1.2 t30 -109.86 76.92 1.0 Allowed Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.65 0.738 . . . . 61.15 110.86 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.521 ' HG2' HD21 ' A' ' 48' ' ' LEU . 53.3 Cg_endo -69.85 168.08 22.71 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.695 2.263 . . . . 65.44 112.297 179.982 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 30.9 p -90.78 161.69 15.18 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.234 -0.439 . . . . 71.32 111.081 -179.91 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 25.2 tt0 -51.95 -43.7 63.62 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.157 -0.474 . . . . 72.33 110.883 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.14 -31.49 64.3 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.142 -0.481 . . . . 61.25 111.063 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 53.7 tt0 -65.96 -48.25 71.93 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.238 -0.437 . . . . 60.04 110.917 -179.938 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.651 ' CD2' HD12 ' A' ' 32' ' ' LEU . 46.4 mt -55.34 -35.35 65.09 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.152 -0.476 . . . . 71.3 110.932 -179.984 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 43.8 tp60 -70.92 -28.96 64.9 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.184 -0.462 . . . . 72.13 110.873 179.945 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 29.3 t0 -68.73 -46.61 68.47 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.216 -0.447 . . . . 65.15 110.869 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' MET . . . . . 0.601 ' SD ' HD11 ' M' ' 34' ' ' ILE . 10.7 mtp -60.18 -53.0 62.9 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.184 -0.462 . . . . 72.31 110.877 179.992 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.667 HG23 HD11 ' A' ' 63' ' ' ILE . 73.3 mt -60.46 -41.25 86.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.226 -0.443 . . . . 51.22 111.159 179.962 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 70.7 m-20 -67.89 -32.73 73.42 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.155 -0.475 . . . . 74.33 110.894 179.934 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 18.4 mm-40 -61.01 -23.28 65.29 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.182 -0.463 . . . . 54.42 110.887 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.49 ' CG2' HD12 ' A' ' 63' ' ' ILE . 3.8 m -112.52 -14.89 10.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.162 -0.472 . . . . 40.01 111.109 179.96 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 33.0 t0 -66.79 97.07 0.44 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.172 -0.467 . . . . 71.51 110.85 179.936 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.46 -32.71 18.12 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.159 -0.473 . . . . 72.1 111.074 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -91.69 -0.43 57.56 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.234 -0.439 . . . . 72.25 110.851 179.983 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 51.46 62.21 5.68 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.699 -0.762 . . . . 41.15 112.509 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 50.7 p-10 -114.58 -15.75 11.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.864 0.364 . . . . 60.24 110.877 -179.873 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 89.11 15.83 58.54 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.751 -0.738 . . . . 63.1 112.49 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' THR . . . . . 0.411 HG22 ' HA ' ' A' ' 28' ' ' THR . 30.7 p -152.17 161.54 42.47 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.758 0.313 . . . . 74.54 111.143 -179.865 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.667 HD11 HG23 ' A' ' 52' ' ' ILE . 8.6 mm -99.26 114.8 38.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.194 -0.457 . . . . 72.52 111.133 179.921 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -81.79 -173.01 4.2 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.153 -0.476 . . . . 63.33 110.88 179.846 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.535 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 2.5 t80 -66.55 -58.3 10.38 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.669 0.747 . . . . 74.41 110.857 -179.911 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 66' ' ' PRO . . . . . 0.535 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 53.1 Cg_endo -69.78 -29.41 23.8 Favored 'Trans proline' 0 C--N 1.342 0.202 0 C-N-CA 122.677 2.251 . . . . 73.45 112.332 -179.947 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -61.48 -40.26 93.91 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.217 -0.447 . . . . 72.04 110.896 -179.976 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 14.7 t80 -74.52 -35.56 63.16 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.149 -0.478 . . . . 53.2 110.886 -179.955 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.562 HD13 ' CB ' ' A' ' 12' ' ' PHE . 19.0 tp -69.98 -54.16 14.49 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.121 -0.49 . . . . 72.21 110.921 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 14.8 t -51.93 -29.77 21.68 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.146 -0.479 . . . . 75.31 111.109 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 3.6 tmm? -61.86 -43.4 98.92 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.247 -0.433 . . . . 74.15 110.844 179.937 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' MET . . . . . 0.586 ' HE3' HG11 ' M' ' 35' ' ' VAL . 3.8 mmt -79.85 -29.4 40.06 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.249 -0.432 . . . . 71.31 110.846 179.999 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -74.84 -28.47 60.7 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.233 -0.44 . . . . 75.14 111.146 179.909 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.11 -19.32 65.81 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.178 -0.465 . . . . 63.22 110.908 -179.952 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 19.7 pttp -51.44 -30.92 21.18 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.178 -0.465 . . . . 74.01 110.887 179.962 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -63.31 -43.46 97.77 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.28 -0.418 . . . . 74.23 110.904 179.864 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 7.7 ttpt -64.44 172.21 2.73 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.201 -0.454 . . . . 74.45 110.884 179.961 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' ASP . . . . . 0.515 ' O ' HG23 ' A' ' 79' ' ' THR . 78.6 m-20 -83.62 136.76 34.1 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.193 -0.458 . . . . 73.12 110.874 179.891 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 79' ' ' THR . . . . . 0.515 HG23 ' O ' ' A' ' 78' ' ' ASP . 0.7 OUTLIER -162.17 84.9 0.58 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.2 -0.455 . . . . 72.1 111.124 -179.857 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -115.36 -29.35 6.58 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.22 -0.445 . . . . 65.13 110.864 179.902 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 1.5 t -64.77 -52.63 55.91 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.223 -0.444 . . . . 73.0 110.866 -179.771 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.636 ' HA ' HD12 ' A' ' 85' ' ' ILE . 61.7 mm-40 -62.87 -25.99 68.56 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.128 -0.487 . . . . 75.41 110.89 -179.974 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 6.5 tm-20 -67.56 -37.5 82.74 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.196 -0.456 . . . . 71.22 110.892 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.65 ' OE2' HD12 ' M' ' 21' ' ' LEU . 53.6 tp10 -77.67 -30.35 51.96 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.091 -0.504 . . . . 62.31 110.921 -179.927 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.636 HD12 ' HA ' ' A' ' 82' ' ' GLU . 47.7 mt -69.63 -51.05 45.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.127 -0.488 . . . . 74.5 111.147 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 2.7 ttt180 -61.13 -32.42 72.12 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.167 -0.469 . . . . 71.14 110.865 179.942 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.715 ' O ' HG23 ' A' ' 91' ' ' VAL . 35.2 mt-10 -76.68 -57.18 4.0 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.224 -0.444 . . . . 62.41 110.9 -179.924 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 88' ' ' ALA . . . . . 0.437 ' HB1' ' CE2' ' A' ' 92' ' ' PHE . . . -53.49 -51.03 64.08 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.177 -0.465 . . . . 55.11 111.081 179.924 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -54.2 -41.79 69.0 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.191 -0.458 . . . . 54.11 110.878 -179.932 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 73.1 ttt180 -70.41 -27.32 64.19 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.161 -0.472 . . . . 62.5 110.9 -179.942 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' VAL . . . . . 0.715 HG23 ' O ' ' A' ' 87' ' ' GLU . 93.7 t -75.61 -28.26 19.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.178 -0.464 . . . . 62.3 111.141 -179.996 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.467 ' CE1' HG11 ' A' ' 108' ' ' VAL . 8.8 m-85 -93.08 -35.64 13.11 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.144 -0.48 . . . . 75.22 110.898 -179.974 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 35.1 t0 -64.67 94.16 0.12 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.125 -0.489 . . . . 61.52 110.857 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 10.1 tppt? -78.64 -51.52 9.76 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.193 -0.458 . . . . 74.35 110.915 179.961 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 17.8 p30 -72.7 -9.14 58.28 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.218 -0.446 . . . . 74.3 110.834 179.919 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 59.76 28.32 65.45 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.713 -0.756 . . . . 62.31 112.528 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 43.8 p-10 -81.85 -16.18 51.64 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.887 0.375 . . . . 70.11 110.893 -179.87 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 91.03 18.64 46.05 Favored Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.717 -0.754 . . . . 73.54 112.5 179.963 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 12.5 m-85 -136.6 148.18 47.36 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.907 0.384 . . . . 71.23 110.933 -179.812 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 78.8 mt -113.78 121.33 65.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.139 -0.482 . . . . 64.22 111.114 179.921 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 17.8 p -116.2 175.25 5.63 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.145 -0.479 . . . . 74.51 110.859 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 102' ' ' ALA . . . . . 0.405 ' HB1' HG12 ' A' ' 121' ' ' VAL . . . -66.33 -33.32 75.48 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.129 -0.487 . . . . 74.34 111.079 179.933 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -61.59 -49.93 74.64 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.251 -0.431 . . . . 73.42 111.076 179.987 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 23.7 mt-10 -76.91 -49.18 16.21 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.207 -0.452 . . . . 74.43 110.925 -179.962 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.535 HD21 ' CE ' ' A' ' 124' ' ' MET . 18.9 tp -53.3 -34.49 57.55 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.114 -0.494 . . . . 54.41 110.931 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 57.4 ttp180 -59.8 -48.05 83.23 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.2 -0.455 . . . . 75.25 110.843 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 70.9 t60 -54.38 -34.39 61.12 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.203 -0.453 . . . . 61.42 110.831 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.467 HG11 ' CE1' ' A' ' 92' ' ' PHE . 42.3 t -65.5 -48.9 81.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.243 -0.435 . . . . 72.43 111.139 -179.994 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 7.6 mmt -59.48 -45.06 92.75 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.163 -0.471 . . . . 54.14 110.866 179.922 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -57.56 -39.11 75.96 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.183 -0.462 . . . . 72.14 111.183 -179.942 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 10.6 t-20 -74.59 -26.55 59.99 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.168 -0.469 . . . . 72.22 110.9 179.966 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 12.3 mt -70.77 -25.97 63.14 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.238 -0.437 . . . . 63.42 110.903 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 101.01 33.02 5.11 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.724 -0.75 . . . . 74.14 112.452 179.862 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -124.05 113.43 18.38 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.948 0.404 . . . . 70.53 110.865 -179.863 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 115' ' ' LYS . . . . . 0.672 ' O ' HD23 ' A' ' 116' ' ' LEU . 9.1 pttm -70.32 118.68 13.44 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.131 -0.486 . . . . 74.42 110.913 179.967 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.672 HD23 ' O ' ' A' ' 115' ' ' LYS . 24.5 mt -137.41 163.3 31.39 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.2 -0.455 . . . . 71.23 110.89 179.97 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 117' ' ' THR . . . . . 0.453 ' O ' HG23 ' A' ' 121' ' ' VAL . 65.9 p -113.01 174.45 5.89 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.22 -0.445 . . . . 74.11 111.132 179.925 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -53.37 -48.11 68.88 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.223 -0.444 . . . . 64.11 110.875 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 49.9 tt0 -62.47 -38.57 90.35 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.23 -0.441 . . . . 72.12 110.886 -179.92 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 120' ' ' GLU . . . . . 0.655 ' HG2' HD22 ' A' ' 116' ' ' LEU . 7.4 tp10 -61.55 -46.77 88.52 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.143 -0.48 . . . . 72.52 110.897 -179.95 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.453 HG23 ' O ' ' A' ' 117' ' ' THR . 62.1 t -57.07 -32.22 39.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.18 -0.464 . . . . 71.32 111.127 179.974 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 3.1 t70 -78.51 -28.49 46.29 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.192 -0.458 . . . . 61.33 110.88 179.919 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 34.5 tp10 -55.6 -50.0 71.28 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.203 -0.453 . . . . 73.32 110.88 -179.928 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 124' ' ' MET . . . . . 0.535 ' CE ' HD21 ' A' ' 105' ' ' LEU . 13.4 ptm -66.61 -44.36 82.29 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.16 -0.473 . . . . 53.35 110.878 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 28.9 mm -53.88 -35.47 27.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.189 -0.46 . . . . 65.12 111.099 179.959 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 18.3 ttt-85 -66.88 -31.58 72.28 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.197 -0.456 . . . . 73.44 110.868 179.983 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 6.9 tm-20 -70.36 -47.26 61.79 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.164 -0.471 . . . . 75.15 110.83 -179.896 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.47 ' HB3' HG22 ' A' ' 136' ' ' VAL . . . -74.23 -33.8 63.47 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.184 -0.462 . . . . 65.32 111.068 179.957 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 50.1 t0 -68.54 86.74 0.31 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.257 -0.429 . . . . 62.33 110.867 -179.999 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 57.7 mt -79.75 -45.61 23.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.182 -0.463 . . . . 73.14 111.116 -179.992 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 22.9 p30 -72.73 -8.69 56.62 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.201 -0.454 . . . . 73.33 110.851 179.864 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 62.31 41.57 99.74 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.769 -0.729 . . . . 62.04 112.517 -179.925 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 34.6 p-10 -86.85 -15.91 37.71 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.851 0.358 . . . . 73.24 110.848 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 101.93 3.72 51.78 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.76 -0.733 . . . . 62.43 112.47 -179.94 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 3.5 tt0 -149.23 172.22 15.21 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.83 0.348 . . . . 53.33 110.895 -179.892 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 136' ' ' VAL . . . . . 0.47 HG22 ' HB3' ' A' ' 128' ' ' ALA . 95.0 t -111.66 108.56 25.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.214 -0.448 . . . . 73.34 111.134 180.0 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 17.5 p30 -86.24 175.62 8.38 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.163 -0.471 . . . . 62.53 110.877 -179.977 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 138' ' ' TYR . . . . . 0.604 ' O ' HG23 ' A' ' 142' ' ' VAL . 39.6 t80 -60.94 -46.52 90.38 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.193 -0.458 . . . . 54.32 110.968 -179.963 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 79.4 tt0 -52.62 -36.45 56.48 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.054 -0.521 . . . . 74.25 110.878 -179.977 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -78.41 -40.62 35.39 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.145 -0.479 . . . . 75.33 110.872 -179.911 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 141' ' ' PHE . . . . . 0.577 ' HD1' HG23 ' A' ' 85' ' ' ILE . 26.7 t80 -62.31 -46.92 86.56 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.177 -0.465 . . . . 74.22 110.88 -179.891 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 142' ' ' VAL . . . . . 0.608 HG13 HD13 ' A' ' 85' ' ' ILE . 83.1 t -51.61 -46.93 38.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.186 -0.461 . . . . 73.32 111.164 179.917 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 143' ' ' GLN . . . . . 0.523 ' O ' ' HB2' ' A' ' 147' ' ' ALA . 3.8 tt0 -71.9 -24.96 61.74 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.175 -0.466 . . . . 70.32 110.939 179.998 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 7.0 tpt -74.04 -42.36 60.38 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.192 -0.458 . . . . 71.13 110.883 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -71.77 -27.7 63.14 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.238 -0.437 . . . . 72.23 110.901 179.926 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 1.8 m -110.41 21.29 16.83 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.239 -0.437 . . . . 72.22 111.098 -179.885 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 147' ' ' ALA . . . . . 0.619 ' HB3' ' NH2' ' M' ' 20' ' ' ARG . . . -75.48 -175.83 2.96 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.232 -0.44 . . . . 65.15 111.095 179.858 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 8.9 tptm . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 116.213 -0.449 . . . . 65.01 110.907 179.924 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' M' M ' 8' ' ' LEU . . . . . . . . . . . . . 5.2 mp . . . . . 0 C--O 1.231 0.1 0 CA-C-O 120.828 0.347 . . . . 71.25 110.93 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' M' M ' 9' ' ' SER . . . . . . . . . . . . . 6.7 m -63.76 -177.2 0.22 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.242 -0.435 . . . . 74.02 110.853 -179.946 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' M' M ' 10' ' ' GLY . . . . . . . . . . . . . . . 173.8 -160.62 30.75 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.737 -0.744 . . . . 70.12 112.468 -179.975 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' M' M ' 11' ' ' GLY . . . . . . . . . . . . . . . -91.46 -82.62 1.44 Allowed Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.731 -0.747 . . . . 31.21 112.517 -179.926 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' M' M ' 12' ' ' GLU . . . . . . . . . . . . . 10.1 mt-10 -60.9 -172.94 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.834 0.35 . . . . 74.54 110.87 -179.859 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' M' M ' 13' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -87.99 75.63 8.74 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.179 -0.464 . . . . 73.1 110.894 -179.967 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' M' M ' 14' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -101.76 24.12 10.34 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.223 -0.444 . . . . 73.53 110.863 179.858 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' M' M ' 15' ' ' LYS . . . . . . . . . . . . . 7.3 mtmp? -79.09 -39.92 32.53 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.178 -0.464 . . . . 70.14 110.917 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' M' M ' 16' ' ' TRP . . . . . 0.721 ' CE3' HD12 ' M' ' 19' ' ' ILE . 18.0 m95 -54.6 -41.14 69.57 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.149 -0.478 . . . . 73.3 110.953 179.917 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' M' M ' 17' ' ' GLU . . . . . . . . . . . . . 15.8 tt0 -57.87 -26.57 62.28 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.215 -0.448 . . . . 71.42 110.862 -179.974 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' M' M ' 18' ' ' LYS . . . . . 0.508 ' O ' HD23 ' M' ' 21' ' ' LEU . 19.8 tttp -73.5 -25.75 60.58 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.165 -0.471 . . . . 54.01 110.916 179.965 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' M' M ' 19' ' ' ILE . . . . . 0.721 HD12 ' CE3' ' M' ' 16' ' ' TRP . 31.5 mt -82.63 -20.96 9.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.194 -0.457 . . . . 73.22 111.103 179.882 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' M' M ' 20' ' ' ARG . . . . . 0.619 ' NH2' ' HB3' ' A' ' 147' ' ' ALA . 36.6 ttm180 -72.62 -27.12 61.96 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.199 -0.455 . . . . 71.44 110.921 179.918 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' M' M ' 21' ' ' LEU . . . . . 0.65 HD12 ' OE2' ' A' ' 84' ' ' GLU . 8.3 mt 52.31 -169.94 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.19 -0.459 . . . . 74.03 110.957 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' M' M ' 22' ' ' ARG . . . . . . . . . . . . . 30.7 ptt85 -160.53 57.01 0.85 Allowed Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.585 0.707 . . . . 71.32 110.904 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' M' M ' 23' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.73 -48.29 0.76 Allowed 'Trans proline' 0 N--CA 1.465 -0.168 0 C-N-CA 122.683 2.255 . . . . 70.43 112.38 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' M' M ' 24' ' ' GLY . . . . . . . . . . . . . . . 133.39 -48.69 0.94 Allowed Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.745 -0.74 . . . . 72.42 112.514 179.987 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' M' M ' 25' ' ' GLY . . . . . . . . . . . . . . . 62.03 164.44 0.35 Allowed Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.756 -0.735 . . . . 35.13 112.477 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' M' M ' 26' ' ' LYS . . . . . . . . . . . . . 42.3 mmtt -151.03 -74.18 0.15 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.889 0.376 . . . . 74.15 110.954 179.975 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' M' M ' 27' ' ' LYS . . . . . . . . . . . . . 51.9 mtmt -150.81 134.97 16.86 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.206 -0.452 . . . . 64.54 110.902 179.813 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' M' M ' 28' ' ' GLN . . . . . . . . . . . . . 4.1 mt-30 -162.28 177.58 9.48 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.207 -0.451 . . . . 74.22 110.882 179.96 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' M' M ' 29' ' ' TYR . . . . . 0.407 ' CE1' HG13 ' A' ' 55' ' ' VAL . 0.4 OUTLIER -176.29 140.75 0.4 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.163 -0.471 . . . . 63.32 110.956 -179.82 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' M' M ' 30' ' ' LYS . . . . . . . . . . . . . 11.4 tttm -88.18 50.0 1.9 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.126 -0.488 . . . . 62.43 110.896 179.946 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' M' M ' 31' ' ' LEU . . . . . 0.569 HD12 HD12 ' M' ' 34' ' ' ILE . 10.0 tp 179.72 -47.87 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.265 -0.425 . . . . 60.12 110.925 179.917 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' M' M ' 32' ' ' LYS . . . . . . . . . . . . . 1.3 ttmm -48.26 -45.8 34.9 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.179 -0.464 . . . . 74.34 110.879 179.816 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' M' M ' 33' ' ' HIS . . . . . . . . . . . . . 35.1 t60 -49.99 -39.82 42.31 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.211 -0.449 . . . . 73.43 110.877 179.928 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' M' M ' 34' ' ' ILE . . . . . 0.601 HD11 ' SD ' ' A' ' 51' ' ' MET . 58.9 mt -50.08 -40.21 16.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.197 -0.456 . . . . 71.11 111.091 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' M' M ' 35' ' ' VAL . . . . . 0.586 HG11 ' HE3' ' A' ' 72' ' ' MET . 62.5 t -48.36 -41.29 10.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.227 -0.442 . . . . 74.42 111.101 179.864 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' M' M ' 36' ' ' TRP . . . . . . . . . . . . . 22.0 m0 -58.43 -40.47 82.6 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.217 -0.447 . . . . 73.12 110.914 179.988 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' M' M ' 37' ' ' ALA . . . . . 0.948 ' HB3' HD13 ' A' ' 39' ' ' LEU . . . -64.09 -18.85 64.79 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.201 -0.454 . . . . 45.55 111.106 179.888 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' M' M ' 38' ' ' SER . . . . . . . . . . . . . 1.1 m -69.31 -17.94 63.77 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.223 -0.444 . . . . 72.2 110.84 -179.764 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' M' M ' 39' ' ' ARG . . . . . . . . . . . . . 45.0 mtp180 -71.51 -21.76 61.88 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.163 -0.471 . . . . 41.42 110.869 -179.93 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' M' M ' 40' ' ' GLU . . . . . . . . . . . . . 22.2 mm-40 -73.94 -48.0 33.71 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.206 -0.452 . . . . 54.42 110.924 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' M' M ' 41' ' ' LEU . . . . . 0.629 HD11 ' OG ' ' A' ' 38' ' ' SER . 13.6 mt -53.76 171.97 0.08 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.174 -0.466 . . . . 73.04 110.939 -179.997 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' M' M ' 42' ' ' GLU . . . . . . . . . . . . . 88.3 mt-10 -80.18 107.06 12.66 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.217 -0.447 . . . . 62.51 110.872 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' M' M ' 43' ' ' ARG . . . . . . . . . . . . . 61.7 mtm180 . . . . . 0 C--N 1.329 -0.3 0 CA-C-N 116.164 -0.471 . . . . 74.11 110.841 -179.911 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 241' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 262' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 301' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 322' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.126 0 CA-C-O 120.757 0.313 . . . . 53.31 111.122 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 64.2 m-20 59.84 30.8 20.35 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.233 -0.44 . . . . 74.2 110.908 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 65.9 mt-30 -67.94 161.17 27.08 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.167 -0.47 . . . . 62.5 110.925 -179.911 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.79 HD22 ' HG2' ' A' ' 8' ' ' GLN . 10.5 mt -127.28 147.71 50.23 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.246 -0.434 . . . . 74.43 110.916 -179.979 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 29.8 p -110.25 177.07 4.81 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.183 -0.462 . . . . 53.02 111.128 179.95 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -56.26 -29.51 61.19 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.184 -0.462 . . . . 74.14 110.859 -179.968 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 21.5 tt0 -67.53 -35.59 79.39 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.179 -0.464 . . . . 74.5 110.907 -179.948 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' GLN . . . . . 0.79 ' HG2' HD22 ' A' ' 4' ' ' LEU . 1.2 tp-100 -77.28 -42.58 36.47 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.172 -0.467 . . . . 72.23 110.899 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ILE . . . . . 0.668 HG23 HD22 ' A' ' 69' ' ' LEU . 54.6 mt -69.68 -40.12 78.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.252 -0.431 . . . . 42.31 111.156 179.931 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.63 -26.05 66.74 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.135 -0.484 . . . . 71.31 111.085 179.847 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 15.4 mm-40 -74.15 -51.93 14.07 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.261 -0.427 . . . . 73.23 110.867 -179.92 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 16.6 m-85 -69.03 -38.06 78.97 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.213 -0.449 . . . . 65.13 110.902 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 19.7 ttmt -52.09 -50.38 61.73 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.141 -0.481 . . . . 71.02 110.928 179.932 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -56.54 -37.25 70.24 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.171 -0.468 . . . . 63.33 110.885 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -59.6 -25.56 64.72 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.169 -0.469 . . . . 54.42 111.071 179.952 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 73.8 t80 -70.94 -54.03 12.84 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.215 -0.448 . . . . 64.34 110.842 -179.895 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 74.9 m -52.79 -31.37 38.23 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.131 -0.486 . . . . 73.33 110.892 -179.768 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.427 HD23 ' HB3' ' M' ' 38' ' ' SER . 16.3 tp -63.07 -39.93 96.18 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.101 -0.499 . . . . 74.42 110.902 -179.996 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.645 ' CD1' HG11 ' A' ' 35' ' ' VAL . 33.7 m-85 -79.61 -35.88 38.86 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.213 -0.449 . . . . 71.44 110.899 179.916 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 16.1 t0 -67.56 98.51 0.68 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.165 -0.47 . . . . 64.04 110.919 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 3.2 tppt? -70.28 -54.31 13.22 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.209 -0.45 . . . . 72.43 110.911 -179.96 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 19.3 p-10 -75.73 -10.04 59.1 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.221 -0.445 . . . . 52.41 110.88 179.848 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 52.18 46.09 56.95 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.732 -0.747 . . . . 60.55 112.482 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 25.0 p-10 -93.59 -15.75 25.08 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.854 0.359 . . . . 64.51 110.891 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 100.32 18.04 22.75 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.789 -0.719 . . . . 42.2 112.479 -179.942 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -154.62 130.82 10.35 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.776 0.322 . . . . 73.51 111.142 -179.858 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.488 HG22 ' HB2' ' A' ' 32' ' ' LEU . 25.6 mt -94.25 119.84 42.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.205 -0.452 . . . . 74.4 111.182 179.896 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.661 HG22 ' CG2' ' A' ' 62' ' ' THR . 20.2 p -107.61 176.24 5.22 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.182 -0.463 . . . . 74.24 111.166 -179.986 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.424 HG23 ' CD1' ' A' ' 52' ' ' ILE . 1.5 p -66.8 -33.95 76.74 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.26 -0.427 . . . . 72.42 111.14 -179.962 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 45.3 mtmt -61.44 -50.13 74.02 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.237 -0.438 . . . . 74.35 110.879 179.923 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.553 ' O ' HG23 ' A' ' 35' ' ' VAL . 8.2 mt-10 -76.06 -52.88 9.24 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.244 -0.435 . . . . 72.44 110.893 179.955 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.488 ' HB2' HG22 ' A' ' 27' ' ' ILE . 3.0 tm? -53.34 -40.67 65.07 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.169 -0.468 . . . . 73.42 110.922 -179.979 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -70.15 -30.66 69.5 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.785 -0.721 . . . . 45.01 112.491 179.893 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 96.6 m -74.48 -46.13 41.58 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.771 0.32 . . . . 74.31 111.12 -179.862 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.645 HG11 ' CD1' ' A' ' 19' ' ' PHE . 47.4 t -51.54 -47.37 36.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.233 -0.44 . . . . 51.42 111.144 179.892 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' MET . . . . . 0.602 ' SD ' HD13 ' M' ' 34' ' ' ILE . 0.0 OUTLIER -56.22 -34.8 66.64 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.2 -0.454 . . . . 73.22 110.869 179.89 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 42.1 ttt-85 -56.41 -40.36 74.56 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.229 -0.442 . . . . 62.45 110.911 -179.912 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' SER . . . . . 0.681 ' OG ' HD21 ' M' ' 41' ' ' LEU . 5.2 t -76.54 -26.26 54.97 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.181 -0.463 . . . . 72.43 110.839 -179.807 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 1.011 HD13 ' HB3' ' M' ' 37' ' ' ALA . 60.9 mt -81.48 -21.92 38.4 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.116 -0.493 . . . . 71.1 110.933 -179.99 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 101.45 31.32 5.57 Favored Glycine 0 N--CA 1.452 -0.251 0 C-N-CA 120.722 -0.751 . . . . 45.14 112.477 179.856 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 5.7 mm100 -122.62 124.82 44.35 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.796 0.331 . . . . 75.01 110.923 -179.895 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 1.1 t30 -109.87 76.58 0.97 Allowed Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.603 0.716 . . . . 74.43 110.911 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.442 ' CG ' HD21 ' A' ' 48' ' ' LEU . 54.2 Cg_endo -69.71 167.97 22.82 Favored 'Trans proline' 0 C--O 1.232 0.177 0 C-N-CA 122.675 2.25 . . . . 72.02 112.397 179.908 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 20.0 p -110.07 154.14 23.66 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.228 -0.442 . . . . 63.24 111.138 -179.963 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 20.5 tt0 -51.91 -38.84 57.78 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.222 -0.445 . . . . 64.43 110.895 -179.994 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.33 -31.61 64.08 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.127 -0.488 . . . . 73.04 111.075 179.9 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -72.77 -52.6 14.39 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.209 -0.45 . . . . 65.41 110.895 -179.9 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.456 HD22 HD12 ' A' ' 32' ' ' LEU . 9.3 mt -55.15 -38.39 68.2 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.128 -0.487 . . . . 74.44 110.928 -179.952 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -64.48 -31.72 73.05 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.145 -0.48 . . . . 71.15 110.935 179.916 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 26.4 t0 -72.65 -42.11 64.71 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.204 -0.453 . . . . 73.42 110.864 179.969 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 41.6 mtp -65.71 -57.4 8.12 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.179 -0.464 . . . . 71.24 110.907 179.963 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.424 ' CD1' HG23 ' A' ' 29' ' ' THR . 62.0 mt -53.27 -45.64 55.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.216 -0.447 . . . . 64.32 111.155 179.941 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 83.0 m-20 -62.71 -29.76 70.9 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.204 -0.453 . . . . 73.42 110.891 179.915 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.36 -22.68 61.11 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.221 -0.445 . . . . 72.14 110.885 -179.983 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 35.7 m -112.96 6.28 8.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.128 -0.487 . . . . 60.25 111.176 179.963 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 30.2 t0 -86.15 97.75 10.51 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.137 -0.483 . . . . 73.42 110.891 179.923 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.28 -41.35 12.96 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.225 -0.443 . . . . 62.52 111.064 -179.993 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 57.7 p-10 -85.71 -0.13 54.32 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.197 -0.456 . . . . 74.12 110.872 -179.993 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 54.27 56.62 20.62 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.731 -0.747 . . . . 73.23 112.534 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 51.6 p-10 -114.4 -15.74 12.05 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.929 0.395 . . . . 75.12 110.914 -179.872 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 90.21 18.99 47.92 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.77 -0.729 . . . . 72.11 112.465 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' THR . . . . . 0.661 ' CG2' HG22 ' A' ' 28' ' ' THR . 73.7 p -150.67 163.81 37.63 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.753 0.311 . . . . 74.05 111.131 -179.881 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 21.7 mt -97.96 111.05 26.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.207 -0.452 . . . . 45.43 111.122 179.909 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -78.43 -172.57 2.93 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.137 -0.483 . . . . 75.12 110.865 179.875 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.541 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 2.4 t80 -65.41 -57.67 14.17 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.623 0.725 . . . . 63.5 110.891 -179.926 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 66' ' ' PRO . . . . . 0.541 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 53.6 Cg_endo -69.78 -23.52 30.61 Favored 'Trans proline' 0 N--CA 1.465 -0.148 0 C-N-CA 122.717 2.278 . . . . 54.31 112.337 -180.0 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 15.2 mt-10 -64.45 -43.09 95.36 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.227 -0.442 . . . . 73.21 110.856 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 41.0 t80 -71.32 -36.76 71.71 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.148 -0.478 . . . . 72.22 110.866 -179.897 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.668 HD22 HG23 ' A' ' 9' ' ' ILE . 57.0 tp -70.87 -53.88 13.54 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.123 -0.49 . . . . 63.51 110.929 -179.98 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.511 HG22 ' O ' ' A' ' 66' ' ' PRO . 12.8 t -59.92 -26.83 66.25 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.148 -0.478 . . . . 54.51 111.159 179.935 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 10.1 tmm? -63.33 -51.15 67.19 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.201 -0.454 . . . . 70.15 110.86 179.923 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -50.89 -45.68 60.2 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.252 -0.431 . . . . 74.51 110.883 179.936 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -75.45 -28.39 59.27 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.194 -0.457 . . . . 63.31 111.113 179.929 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 31.0 ttm180 -68.53 -18.55 64.38 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.194 -0.457 . . . . 61.44 110.869 -179.902 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 23.2 pttm -50.49 -30.14 12.13 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.163 -0.472 . . . . 74.31 110.904 179.972 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 40.7 mtt -52.5 -28.95 22.57 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.222 -0.445 . . . . 71.22 110.909 179.841 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 20.6 pttm -142.34 -169.35 2.94 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.216 -0.447 . . . . 74.51 110.899 179.963 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 63.4 m-20 52.33 73.21 0.35 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.218 -0.446 . . . . 74.24 110.885 179.831 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' THR . . . . . 0.64 HG21 ' H ' ' M' ' 28' ' ' GLN . 1.9 t 178.93 158.67 0.56 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.205 -0.452 . . . . 64.53 111.127 -179.889 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -173.56 -74.34 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.195 -0.457 . . . . 72.13 110.896 179.916 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 63.1 m -52.16 -30.02 24.85 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.206 -0.452 . . . . 75.0 110.796 -179.745 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 15.7 tp10 -71.0 -59.27 2.87 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.148 -0.478 . . . . 73.02 110.914 -179.933 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -52.67 -35.86 55.96 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.151 -0.477 . . . . 64.3 110.893 -179.993 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -62.9 -39.66 95.21 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.171 -0.468 . . . . 64.24 110.897 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.762 HG21 HG22 ' A' ' 142' ' ' VAL . 39.1 mt -74.95 -50.75 23.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.166 -0.47 . . . . 74.22 111.13 -179.985 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 13.9 ttt180 -59.95 -41.72 92.47 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.17 -0.468 . . . . 71.21 110.867 179.962 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.693 ' O ' HG23 ' A' ' 91' ' ' VAL . 28.3 tt0 -52.11 -47.86 65.06 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.213 -0.449 . . . . 74.54 110.872 -179.946 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 88' ' ' ALA . . . . . 0.505 ' HB1' ' CE2' ' A' ' 92' ' ' PHE . . . -74.55 -50.04 19.57 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.134 -0.485 . . . . 75.44 111.087 179.936 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 4.3 t80 -51.92 -34.53 42.01 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.231 -0.441 . . . . 63.04 110.838 -179.902 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -72.93 -46.01 54.89 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.156 -0.475 . . . . 73.35 110.903 -179.884 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 91' ' ' VAL . . . . . 0.693 HG23 ' O ' ' A' ' 87' ' ' GLU . 65.1 t -61.16 -31.01 48.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.181 -0.463 . . . . 74.5 111.156 179.922 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.697 ' CE1' HG11 ' A' ' 108' ' ' VAL . 21.0 m-85 -86.42 -44.07 12.32 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.156 -0.475 . . . . 74.15 110.93 179.972 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 44.2 t0 -67.78 87.95 0.24 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.123 -0.489 . . . . 64.31 110.866 179.979 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 2.3 tppt? -78.56 -47.16 17.79 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.212 -0.449 . . . . 63.43 110.863 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 9.5 p30 -72.65 -9.06 58.16 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.236 -0.438 . . . . 75.42 110.858 179.901 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 60.35 31.16 73.02 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.729 -0.748 . . . . 62.31 112.487 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 34.0 p-10 -81.89 -16.15 51.59 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.863 0.363 . . . . 75.23 110.879 -179.87 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 81.88 18.65 67.22 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.681 -0.771 . . . . 64.33 112.479 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 14.1 m-85 -142.49 142.93 32.36 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.852 0.358 . . . . 72.25 110.887 -179.808 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 62.3 mt -108.0 130.49 60.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.072 -0.513 . . . . 72.14 111.13 179.945 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 96.6 p -115.24 -171.76 2.01 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.201 -0.454 . . . . 62.33 110.86 -179.908 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 102' ' ' ALA . . . . . 0.607 ' HB2' HG13 ' A' ' 125' ' ' ILE . . . -76.15 -40.12 53.38 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.136 -0.484 . . . . 73.33 111.079 179.95 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -64.16 -37.95 89.31 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.168 -0.469 . . . . 64.41 111.106 179.962 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 104' ' ' GLU . . . . . 0.737 ' O ' HG23 ' A' ' 108' ' ' VAL . 56.6 mt-10 -67.83 -50.27 57.64 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.221 -0.445 . . . . 64.52 110.885 -179.948 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.554 HD11 HD13 ' M' ' 19' ' ' ILE . 22.1 tp -55.25 -54.86 38.08 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.12 -0.491 . . . . 74.5 110.877 -179.938 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 106' ' ' ARG . . . . . 0.444 ' O ' HG23 ' A' ' 110' ' ' THR . 37.0 ttp180 -52.24 -44.81 65.04 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.224 -0.443 . . . . 75.32 110.884 179.971 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 67.3 t60 -59.48 -34.38 72.5 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.149 -0.478 . . . . 70.51 110.892 179.969 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.737 HG23 ' O ' ' A' ' 104' ' ' GLU . 21.7 t -74.49 -52.37 19.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.196 -0.456 . . . . 64.31 111.142 179.977 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 109' ' ' MET . . . . . 0.747 ' HG2' HD11 ' A' ' 116' ' ' LEU . 0.3 OUTLIER -60.41 -41.94 94.97 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.148 -0.478 . . . . 73.14 110.901 179.896 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 110' ' ' THR . . . . . 0.444 HG23 ' O ' ' A' ' 106' ' ' ARG . 11.3 p -53.51 -32.35 50.0 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.192 -0.458 . . . . 74.43 111.088 -179.936 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 22.6 t-20 -74.6 -29.41 61.3 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.243 -0.435 . . . . 74.42 110.876 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 2.1 mt -70.68 -24.36 62.66 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.219 -0.446 . . . . 64.14 110.905 179.944 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 101.02 32.93 5.14 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.765 -0.731 . . . . 64.03 112.531 179.924 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -112.4 114.54 27.31 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.917 0.389 . . . . 71.51 110.874 -179.832 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 3.2 ttpm? -64.61 123.35 19.07 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.158 -0.474 . . . . 64.22 110.881 179.947 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.747 HD11 ' HG2' ' A' ' 109' ' ' MET . 8.5 mt -141.34 155.79 45.91 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.181 -0.463 . . . . 70.34 110.926 179.901 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 30.3 p -118.87 167.47 11.68 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.227 -0.442 . . . . 54.4 111.177 179.911 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 69.8 m-20 -51.98 -37.53 53.43 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.218 -0.447 . . . . 73.33 110.852 179.927 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -72.67 -34.85 67.5 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.2 -0.454 . . . . 74.44 110.881 -179.891 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -64.91 -45.87 84.1 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.178 -0.465 . . . . 61.43 110.842 -179.917 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.487 ' CG1' ' HB1' ' A' ' 102' ' ' ALA . 88.9 t -56.21 -30.65 30.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.179 -0.464 . . . . 63.33 111.153 179.98 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 54.8 t0 -66.52 -45.67 78.73 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.173 -0.467 . . . . 73.14 110.864 179.921 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -55.82 -29.48 59.86 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.213 -0.449 . . . . 72.11 110.906 -179.914 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 25.1 mtp -75.76 -59.51 2.72 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.171 -0.468 . . . . 74.53 110.896 179.935 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.607 HG13 ' HB2' ' A' ' 102' ' ' ALA . 34.2 mm -54.08 -35.61 29.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.243 -0.435 . . . . 64.42 111.156 179.981 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 4.9 tmm_? -66.3 -31.72 72.69 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.135 -0.484 . . . . 75.3 110.873 179.953 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -70.67 -48.22 55.93 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.231 -0.44 . . . . 74.24 110.897 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.543 ' HB3' ' CG2' ' A' ' 136' ' ' VAL . . . -73.12 -33.05 65.32 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.175 -0.466 . . . . 43.44 111.1 179.931 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 50.6 t0 -69.18 86.31 0.39 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.196 -0.456 . . . . 71.4 110.898 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 130' ' ' ILE . . . . . 0.669 HD12 ' HG2' ' A' ' 140' ' ' GLU . 3.5 mt -79.95 -45.24 22.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.219 -0.446 . . . . 62.25 111.131 179.998 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 23.3 p30 -72.65 -8.9 57.6 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.188 -0.46 . . . . 74.03 110.881 179.855 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 62.94 45.36 95.82 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.747 -0.74 . . . . 52.42 112.506 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 31.6 p-10 -91.65 -16.15 27.46 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.894 0.378 . . . . 73.13 110.885 -179.957 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 101.94 3.8 51.7 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.73 -0.747 . . . . 64.41 112.489 -179.937 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 5.8 tt0 -149.34 172.31 15.11 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.832 0.349 . . . . 71.12 110.917 -179.882 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 136' ' ' VAL . . . . . 0.543 ' CG2' ' HB3' ' A' ' 128' ' ' ALA . 67.8 t -115.55 114.29 45.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.185 -0.461 . . . . 65.34 111.099 179.967 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 48.4 p-10 -94.01 -172.41 2.83 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.123 -0.489 . . . . 70.13 110.899 179.979 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 138' ' ' TYR . . . . . 0.732 ' O ' HG23 ' A' ' 142' ' ' VAL . 47.5 t80 -68.46 -49.26 61.15 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.185 -0.461 . . . . 74.14 110.918 -179.927 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -51.63 -46.68 63.73 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.172 -0.467 . . . . 64.51 110.884 179.982 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 140' ' ' GLU . . . . . 0.669 ' HG2' HD12 ' A' ' 130' ' ' ILE . 97.5 mt-10 -70.87 -40.86 72.03 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.162 -0.472 . . . . 72.11 110.929 -179.949 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 88.0 t80 -59.68 -35.5 74.58 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.12 -0.491 . . . . 70.32 110.917 -179.969 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 142' ' ' VAL . . . . . 0.762 HG22 HG21 ' A' ' 85' ' ' ILE . 94.2 t -64.1 -37.52 80.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.104 -0.498 . . . . 33.33 111.112 -179.99 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 16.4 tm0? -70.34 -33.13 71.11 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.152 -0.477 . . . . 64.41 110.951 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 8.8 tpt -74.71 -56.31 4.93 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.225 -0.443 . . . . 71.14 110.885 179.919 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 5.0 ttm -60.54 -27.91 68.02 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.216 -0.447 . . . . 73.43 110.906 179.952 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 2.5 m -111.42 21.33 16.34 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.209 -0.45 . . . . 63.41 111.116 -179.924 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -51.68 114.27 1.22 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.182 -0.463 . . . . 51.45 111.112 179.819 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 8.5 mtmp? . . . . . 0 C--N 1.329 -0.325 0 CA-C-N 116.244 -0.434 . . . . 74.44 110.873 179.975 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' M' M ' 8' ' ' LEU . . . . . . . . . . . . . 26.6 mt . . . . . 0 C--O 1.231 0.1 0 CA-C-O 120.795 0.331 . . . . 74.22 110.93 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' M' M ' 9' ' ' SER . . . . . . . . . . . . . 11.2 t -57.99 116.19 3.35 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.172 -0.467 . . . . 43.32 110.862 -179.892 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' M' M ' 10' ' ' GLY . . . . . . . . . . . . . . . -130.16 35.33 2.54 Favored Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.74 -0.743 . . . . 51.55 112.453 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' M' M ' 11' ' ' GLY . . . . . . . . . . . . . . . -80.42 -112.56 0.29 Allowed Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.761 -0.733 . . . . 63.21 112.497 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' M' M ' 12' ' ' GLU . . . . . . . . . . . . . 15.1 pt-20 -95.38 179.25 5.23 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.853 0.359 . . . . 70.22 110.917 -179.873 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' M' M ' 13' ' ' LEU . . . . . 0.596 HD11 ' HG2' ' M' ' 15' ' ' LYS . 17.4 tp -53.76 106.82 0.2 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.179 -0.464 . . . . 70.53 110.956 179.991 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' M' M ' 14' ' ' ASP . . . . . . . . . . . . . 28.8 t0 -101.1 68.83 1.26 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.208 -0.451 . . . . 63.23 110.845 179.85 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' M' M ' 15' ' ' LYS . . . . . 0.596 ' HG2' HD11 ' M' ' 13' ' ' LEU . 19.2 mtmm -52.61 -46.58 67.07 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.151 -0.477 . . . . 70.15 110.894 179.975 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' M' M ' 16' ' ' TRP . . . . . 0.783 ' CE3' HD12 ' M' ' 19' ' ' ILE . 17.9 m95 -52.06 -47.21 65.23 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.251 -0.432 . . . . 71.31 110.943 179.934 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' M' M ' 17' ' ' GLU . . . . . . . . . . . . . 18.1 tt0 -57.47 -26.22 60.92 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.282 -0.417 . . . . 74.51 110.892 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' M' M ' 18' ' ' LYS . . . . . . . . . . . . . 6.0 ttpm? -73.06 -25.8 61.05 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.11 -0.496 . . . . 73.32 110.885 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' M' M ' 19' ' ' ILE . . . . . 0.783 HD12 ' CE3' ' M' ' 16' ' ' TRP . 28.7 mt -76.64 -21.79 14.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.253 -0.431 . . . . 45.45 111.116 179.896 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' M' M ' 20' ' ' ARG . . . . . . . . . . . . . 43.1 ttt180 -51.69 -39.82 58.97 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.187 -0.46 . . . . 74.31 110.859 179.931 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' M' M ' 21' ' ' LEU . . . . . . . . . . . . . 4.5 mt 53.57 -172.26 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.176 -0.465 . . . . 72.34 110.948 -179.901 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' M' M ' 22' ' ' ARG . . . . . . . . . . . . . 49.7 ttm-85 -106.45 136.83 19.33 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.558 0.694 . . . . 70.45 110.895 179.963 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' M' M ' 23' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.78 163.63 37.56 Favored 'Trans proline' 0 C--N 1.341 0.149 0 C-N-CA 122.704 2.269 . . . . 61.32 112.308 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' M' M ' 24' ' ' GLY . . . . . . . . . . . . . . . -141.86 -85.93 0.09 OUTLIER Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.742 -0.742 . . . . 73.31 112.54 179.948 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' M' M ' 25' ' ' GLY . . . . . . . . . . . . . . . -77.12 148.73 34.9 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.751 -0.738 . . . . 51.14 112.483 -179.909 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' M' M ' 26' ' ' LYS . . . . . 0.464 ' O ' HG23 ' A' ' 79' ' ' THR . 15.4 mmtp -136.29 65.72 1.51 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.845 0.355 . . . . 73.12 110.907 -179.924 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' M' M ' 27' ' ' LYS . . . . . . . . . . . . . 14.9 mtpp -147.03 78.63 1.49 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.265 -0.425 . . . . 75.31 110.893 179.868 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' M' M ' 28' ' ' GLN . . . . . 0.64 ' H ' HG21 ' A' ' 79' ' ' THR . 36.4 tp60 -178.41 120.98 0.09 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.248 -0.433 . . . . 74.52 110.93 179.969 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' M' M ' 29' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -67.77 -177.44 0.79 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.189 -0.46 . . . . 75.43 110.933 -179.873 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' M' M ' 30' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -124.06 27.4 7.17 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.108 -0.496 . . . . 74.33 110.878 179.908 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' M' M ' 31' ' ' LEU . . . . . 0.665 HD12 HD12 ' M' ' 34' ' ' ILE . 12.3 tp -136.73 -41.25 0.61 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.226 -0.443 . . . . 51.12 110.924 179.886 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' M' M ' 32' ' ' LYS . . . . . . . . . . . . . 12.2 ptmm? -47.13 -42.15 18.79 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.247 -0.433 . . . . 64.24 110.911 179.791 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' M' M ' 33' ' ' HIS . . . . . . . . . . . . . 19.4 t60 -49.12 -44.4 42.33 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.218 -0.446 . . . . 73.43 110.843 179.871 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' M' M ' 34' ' ' ILE . . . . . 0.665 HD12 HD12 ' M' ' 31' ' ' LEU . 77.7 mt -51.54 -38.34 20.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.199 -0.455 . . . . 52.24 111.168 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' M' M ' 35' ' ' VAL . . . . . . . . . . . . . 38.1 t -50.14 -39.17 15.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.195 -0.457 . . . . 73.52 111.08 179.872 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' M' M ' 36' ' ' TRP . . . . . . . . . . . . . 22.5 m0 -59.06 -39.13 81.11 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.182 -0.463 . . . . 75.22 110.907 179.966 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' M' M ' 37' ' ' ALA . . . . . 1.011 ' HB3' HD13 ' A' ' 39' ' ' LEU . . . -64.22 -18.52 64.59 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.222 -0.445 . . . . 72.04 111.099 179.939 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' M' M ' 38' ' ' SER . . . . . 0.427 ' HB3' HD23 ' A' ' 18' ' ' LEU . 0.7 OUTLIER -73.13 -17.87 61.35 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.215 -0.448 . . . . 61.24 110.817 -179.744 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' M' M ' 39' ' ' ARG . . . . . . . . . . . . . 1.4 tpt180 -58.68 -25.6 63.0 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.165 -0.47 . . . . 74.51 110.897 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' M' M ' 40' ' ' GLU . . . . . . . . . . . . . 2.4 pt-20 -87.07 -27.89 22.88 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.142 -0.481 . . . . 72.22 110.894 -179.939 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' M' M ' 41' ' ' LEU . . . . . 0.681 HD21 ' OG ' ' A' ' 38' ' ' SER . 11.3 mt -82.21 131.14 35.23 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.147 -0.478 . . . . 72.24 110.923 179.993 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' M' M ' 42' ' ' GLU . . . . . . . . . . . . . 75.4 tt0 -168.34 142.64 3.34 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.166 -0.47 . . . . 74.42 110.836 179.92 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' M' M ' 43' ' ' ARG . . . . . . . . . . . . . 19.8 ptt180 . . . . . 0 C--N 1.33 -0.278 0 CA-C-N 116.11 -0.496 . . . . 74.12 110.905 -179.962 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 241' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 262' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 301' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 322' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.1 0 CA-C-O 120.826 0.346 . . . . 71.44 111.074 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 19.8 m-20 -134.27 139.4 45.7 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.207 -0.451 . . . . 75.44 110.832 -179.97 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 14.5 pt20 -138.36 169.85 17.07 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.181 -0.463 . . . . 63.13 110.895 -179.897 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.519 HD12 HG13 ' A' ' 9' ' ' ILE . 2.8 mm? -84.83 109.31 18.01 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.18 -0.463 . . . . 73.22 110.904 179.995 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.739 ' O ' HD12 ' A' ' 9' ' ' ILE . 27.4 p -111.07 171.69 7.32 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.204 -0.453 . . . . 71.34 111.146 179.914 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 9.7 tt0 -52.17 -45.22 65.02 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.219 -0.446 . . . . 74.44 110.884 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -61.39 -26.77 68.07 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.135 -0.484 . . . . 73.2 110.9 -179.91 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' GLN . . . . . 0.459 ' CG ' HD13 ' A' ' 4' ' ' LEU . 24.6 tt0 -77.92 -57.46 3.79 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.162 -0.472 . . . . 74.42 110.904 -179.968 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ILE . . . . . 0.739 HD12 ' O ' ' A' ' 5' ' ' THR . 3.2 mp -62.66 -52.33 61.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.235 -0.439 . . . . 75.22 111.077 -179.976 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -52.0 -33.76 39.74 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.187 -0.461 . . . . 74.45 111.114 179.8 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -74.9 -51.66 13.28 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.192 -0.458 . . . . 72.21 110.864 -179.897 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 16.5 m-85 -58.2 -42.22 85.69 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.17 -0.468 . . . . 53.31 110.891 -179.899 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -51.91 -37.85 54.04 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.131 -0.486 . . . . 72.41 110.892 179.986 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 -66.13 -35.83 81.52 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.252 -0.431 . . . . 50.13 110.831 179.978 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -65.63 -41.06 93.08 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.164 -0.471 . . . . 73.14 111.078 179.943 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.406 ' CE1' HD11 ' A' ' 27' ' ' ILE . 85.3 t80 -53.4 -51.58 62.1 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.253 -0.43 . . . . 72.44 110.881 -179.927 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 14.7 p -53.23 -32.71 49.63 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.176 -0.465 . . . . 64.44 110.857 -179.824 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 17.5 tp -64.58 -38.92 92.68 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.141 -0.481 . . . . 74.25 110.879 -179.991 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.642 ' CE1' HG11 ' A' ' 35' ' ' VAL . 48.1 m-85 -82.04 -27.65 32.92 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.233 -0.44 . . . . 75.12 110.888 179.966 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -82.83 98.56 9.21 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.164 -0.471 . . . . 54.25 110.835 179.962 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 40.4 mmtt -69.91 -54.14 14.73 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.197 -0.456 . . . . 73.35 110.878 179.969 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 22.3 p-10 -77.2 -10.12 59.21 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.215 -0.448 . . . . 72.31 110.879 179.879 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 52.02 42.26 54.07 Favored Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.726 -0.75 . . . . 73.41 112.453 -179.959 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 29.9 p-10 -88.57 -15.66 34.53 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.872 0.367 . . . . 71.11 110.882 -179.998 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 105.4 -11.74 47.36 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.723 -0.751 . . . . 74.12 112.463 -179.965 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 34.0 p -125.8 130.78 52.1 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.723 0.297 . . . . 54.43 111.168 -179.818 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.532 HG22 ' HB2' ' A' ' 32' ' ' LEU . 25.0 mt -98.58 125.98 51.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.241 -0.436 . . . . 74.44 111.108 179.969 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.762 HG22 HG22 ' A' ' 62' ' ' THR . 73.9 p -111.41 -178.51 3.47 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.188 -0.46 . . . . 72.31 111.1 -179.998 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.521 HG23 ' CD1' ' A' ' 52' ' ' ILE . 2.0 p -66.57 -26.76 67.27 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.214 -0.448 . . . . 71.24 111.147 -179.966 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 2.2 tppp? -75.07 -50.19 17.25 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.224 -0.444 . . . . 71.41 110.883 179.878 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 28.4 mt-10 -71.32 -40.38 70.8 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.266 -0.425 . . . . 74.15 110.843 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.532 ' HB2' HG22 ' A' ' 27' ' ' ILE . 3.9 tt -74.07 -49.19 25.18 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.199 -0.455 . . . . 61.23 110.921 -179.988 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -54.25 -27.94 41.13 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.771 -0.728 . . . . 73.01 112.453 179.93 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 95.1 m -68.97 -53.47 20.53 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.827 0.346 . . . . 75.14 111.095 -179.828 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.642 HG11 ' CE1' ' A' ' 19' ' ' PHE . 39.2 t -51.76 -51.42 27.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.223 -0.444 . . . . 60.41 111.172 179.89 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 7.5 mtt -54.21 -49.14 70.09 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.126 -0.488 . . . . 71.32 110.859 179.94 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 2.6 tmt_? -59.1 -42.6 90.87 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.205 -0.452 . . . . 62.21 110.887 -179.929 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' SER . . . . . 0.632 ' OG ' HD21 ' M' ' 41' ' ' LEU . 4.2 t -57.5 -29.9 64.68 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.14 -0.482 . . . . 72.41 110.859 -179.785 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.992 HD13 ' HB3' ' M' ' 37' ' ' ALA . 9.3 mt -91.91 -4.38 54.78 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.13 -0.486 . . . . 74.11 110.957 179.988 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 101.42 -13.15 58.4 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.738 -0.744 . . . . 73.15 112.523 179.943 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -81.48 96.27 7.35 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.855 0.359 . . . . 71.42 110.917 -179.883 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 6.4 t-20 -109.74 82.67 2.4 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.672 0.749 . . . . 62.21 110.874 -179.952 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.8 168.05 22.72 Favored 'Trans proline' 0 C--N 1.342 0.187 0 C-N-CA 122.719 2.279 . . . . 45.32 112.332 179.949 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 20.0 p -83.98 158.35 21.55 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.224 -0.443 . . . . 72.31 111.128 -179.947 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 15.1 mp0 -51.97 -48.36 64.38 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.228 -0.442 . . . . 60.0 110.914 179.98 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.78 -31.55 72.59 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.159 -0.473 . . . . 63.41 111.062 179.967 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -68.28 -52.0 38.73 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.259 -0.428 . . . . 74.44 110.915 -179.908 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 25.3 mt -55.09 -48.67 73.24 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.122 -0.49 . . . . 72.04 110.904 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 17.5 tp60 -54.4 -29.43 48.93 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.212 -0.449 . . . . 64.5 110.91 179.932 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' ASP . . . . . 0.73 ' OD2' HG21 ' A' ' 146' ' ' THR . 46.1 t0 -74.49 -29.53 61.46 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.189 -0.46 . . . . 73.42 110.862 179.989 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 51' ' ' MET . . . . . 0.622 ' HE2' HD13 ' M' ' 31' ' ' LEU . 41.5 mtp -73.14 -58.06 3.58 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.174 -0.467 . . . . 70.34 110.857 -179.974 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.521 ' CD1' HG23 ' A' ' 29' ' ' THR . 62.0 mt -53.32 -52.75 28.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.22 -0.446 . . . . 72.2 111.105 179.981 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 78.4 m-20 -57.0 -25.28 58.21 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.236 -0.438 . . . . 71.52 110.894 179.967 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -75.54 -28.33 59.02 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.145 -0.48 . . . . 63.24 110.87 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 9.8 m -109.81 10.87 8.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.164 -0.471 . . . . 60.53 111.104 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 28.8 t0 -86.69 99.99 12.15 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.199 -0.455 . . . . 62.04 110.869 179.89 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.3 -46.87 8.85 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.163 -0.471 . . . . 70.35 111.126 179.911 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 50.7 p30 -81.63 -0.3 41.84 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.226 -0.443 . . . . 71.34 110.88 -179.998 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 55.26 55.47 28.19 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.734 -0.746 . . . . 43.0 112.517 -179.916 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 50.3 p-10 -114.55 -15.76 11.97 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.863 0.363 . . . . 43.33 110.872 -179.858 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 89.39 20.46 44.98 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.705 -0.76 . . . . 64.33 112.527 -179.981 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' THR . . . . . 0.762 HG22 HG22 ' A' ' 28' ' ' THR . 71.4 p -150.49 161.1 43.18 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.723 0.296 . . . . 73.04 111.117 -179.814 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.429 HG21 ' HD1' ' A' ' 68' ' ' PHE . 22.9 mt -98.98 114.59 37.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.214 -0.448 . . . . 71.41 111.151 179.882 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.4 t0 -82.33 -172.84 4.22 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.213 -0.449 . . . . 74.44 110.86 179.902 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.529 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 2.4 t80 -65.1 -58.21 13.23 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.65 0.738 . . . . 65.14 110.867 -179.89 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 66' ' ' PRO . . . . . 0.529 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 53.9 Cg_endo -69.74 -24.26 29.98 Favored 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.674 2.25 . . . . 52.23 112.315 -179.968 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 75.9 mt-10 -65.29 -41.78 93.8 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.254 -0.43 . . . . 73.13 110.917 -179.964 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' PHE . . . . . 0.429 ' HD1' HG21 ' A' ' 63' ' ' ILE . 26.5 t80 -72.54 -36.11 68.19 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.148 -0.478 . . . . 63.52 110.863 -179.932 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 50.2 tp -68.98 -53.67 19.39 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.137 -0.483 . . . . 74.35 110.901 -179.973 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 13.3 t -58.44 -26.67 63.58 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.242 -0.436 . . . . 64.33 111.137 179.936 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 5.3 tmm? -62.25 -50.41 71.84 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.243 -0.435 . . . . 72.32 110.868 179.94 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 1.2 mmt -51.61 -45.39 63.2 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.215 -0.448 . . . . 74.22 110.88 179.951 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -75.03 -28.58 60.53 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.238 -0.437 . . . . 61.23 111.1 179.967 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 19.5 tpp180 -67.48 -18.0 64.9 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.18 -0.464 . . . . 73.21 110.891 -179.929 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 8.4 pttp -50.41 -29.62 10.58 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.168 -0.469 . . . . 74.11 110.886 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 88.4 mmm -51.45 -29.88 17.69 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.212 -0.449 . . . . 74.43 110.854 179.881 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 7.9 ptpt -178.94 111.89 0.06 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.251 -0.431 . . . . 63.1 110.891 179.922 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 10.8 t70 -144.7 -68.62 0.31 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.241 -0.436 . . . . 73.1 110.858 179.883 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 1.7 m -121.15 137.7 54.55 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.204 -0.453 . . . . 55.4 111.146 -179.883 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -112.2 -35.66 5.56 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.217 -0.447 . . . . 42.24 110.854 179.929 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 1.1 m -54.4 -33.6 59.6 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.227 -0.442 . . . . 71.14 110.852 -179.763 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 11.1 tp10 -60.98 -52.74 63.74 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.155 -0.475 . . . . 71.13 110.933 -179.979 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -53.18 -37.24 61.74 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.144 -0.48 . . . . 74.01 110.858 -179.919 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 15.8 tt0 -60.92 -33.57 73.35 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.147 -0.479 . . . . 65.35 110.873 -179.916 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.462 HG23 ' CE1' ' A' ' 141' ' ' PHE . 61.9 mt -70.23 -44.86 77.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.156 -0.475 . . . . 42.4 111.142 179.961 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 53.6 ttp180 -72.02 -32.92 67.63 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.193 -0.458 . . . . 74.13 110.871 179.975 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 24.9 mm-40 -76.56 -48.29 19.78 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.165 -0.471 . . . . 74.41 110.939 -179.975 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -53.37 -43.01 67.44 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.182 -0.463 . . . . 74.34 111.122 179.883 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.402 ' CD1' HD11 ' A' ' 100' ' ' ILE . 36.0 t80 -52.01 -37.28 52.76 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.244 -0.434 . . . . 71.11 110.875 -179.937 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 3.4 tmt_? -71.0 -38.67 72.66 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.128 -0.487 . . . . 74.33 110.845 -179.888 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 31.5 t -62.21 -48.13 89.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.196 -0.456 . . . . 75.42 111.13 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.496 ' CE1' HG11 ' A' ' 108' ' ' VAL . 9.9 m-85 -68.3 -26.3 65.57 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.186 -0.461 . . . . 73.15 110.875 -179.987 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 37.6 t0 -72.84 92.81 1.63 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.151 -0.477 . . . . 75.41 110.873 179.948 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 34.4 ttmt -78.57 -51.02 10.53 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.192 -0.458 . . . . 62.3 110.882 179.985 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 24.0 p30 -72.44 -9.1 58.11 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.228 -0.442 . . . . 61.33 110.866 179.87 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 60.0 29.37 67.86 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.779 -0.724 . . . . 70.12 112.482 -179.951 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 42.6 p-10 -82.98 -16.15 48.37 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.91 0.386 . . . . 73.43 110.908 -179.884 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 93.66 18.7 37.13 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.709 -0.757 . . . . 74.21 112.469 179.965 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 21.8 m-85 -139.26 165.56 26.86 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.884 0.373 . . . . 74.3 110.909 -179.799 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.402 HD11 ' CD1' ' A' ' 89' ' ' PHE . 77.5 mt -122.37 114.56 43.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.135 -0.484 . . . . 62.33 111.126 179.91 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 4.9 p -102.52 174.93 5.68 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.174 -0.466 . . . . 72.53 110.906 -179.927 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 102' ' ' ALA . . . . . 0.54 ' HB2' HG13 ' A' ' 125' ' ' ILE . . . -67.73 -30.2 69.62 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.191 -0.459 . . . . 61.01 111.124 179.889 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -68.13 -43.91 77.27 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.17 -0.468 . . . . 34.32 111.15 179.912 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 91.0 mt-10 -74.13 -47.68 34.52 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.193 -0.458 . . . . 71.44 110.875 -179.934 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 34.8 tp -53.86 -49.78 67.72 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.159 -0.473 . . . . 73.21 110.916 -179.944 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 106' ' ' ARG . . . . . 0.471 ' HB2' HG21 ' A' ' 121' ' ' VAL . 26.3 ttt180 -52.25 -41.62 62.96 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.191 -0.458 . . . . 52.41 110.876 179.923 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 27.3 t60 -59.74 -34.47 72.99 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.232 -0.44 . . . . 75.21 110.903 179.984 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.496 HG11 ' CE1' ' A' ' 92' ' ' PHE . 38.3 t -66.86 -45.71 86.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.193 -0.458 . . . . 53.14 111.153 179.956 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 109' ' ' MET . . . . . 0.471 ' HB3' HD12 ' A' ' 116' ' ' LEU . 3.4 mmt -60.59 -37.0 79.91 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.186 -0.461 . . . . 63.41 110.85 179.939 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 2.1 m -55.03 -34.33 63.41 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.236 -0.438 . . . . 71.04 111.152 -179.948 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 4.9 t-20 -70.96 -30.69 67.05 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.22 -0.446 . . . . 62.41 110.87 179.974 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.434 HD13 ' HE2' ' M' ' 18' ' ' LYS . 18.1 mt -73.01 -26.28 61.27 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.189 -0.46 . . . . 63.23 110.918 179.967 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 99.9 30.13 6.56 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.767 -0.73 . . . . 52.44 112.465 179.874 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -115.14 112.69 22.94 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.915 0.388 . . . . 62.31 110.87 -179.876 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.57 119.77 12.28 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.127 -0.488 . . . . 62.22 110.87 179.951 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.471 HD12 ' HB3' ' A' ' 109' ' ' MET . 7.8 mt -140.49 155.82 46.54 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.215 -0.448 . . . . 74.14 110.891 179.883 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 117' ' ' THR . . . . . 0.631 ' O ' HG23 ' A' ' 121' ' ' VAL . 52.5 p -115.03 170.54 8.27 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.181 -0.463 . . . . 74.11 111.141 179.958 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 20.6 m-20 -58.71 -33.21 69.94 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.215 -0.448 . . . . 75.41 110.857 179.909 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 22.5 tp10 -75.68 -33.46 60.39 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.184 -0.462 . . . . 72.34 110.865 -179.882 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 13.7 tt0 -71.15 -31.77 68.12 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.171 -0.468 . . . . 61.35 110.856 -179.914 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.631 HG23 ' O ' ' A' ' 117' ' ' THR . 43.5 t -71.27 -31.96 45.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.187 -0.461 . . . . 63.41 111.153 179.963 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 12.2 t0 -51.98 -46.86 65.02 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.137 -0.483 . . . . 65.34 110.811 179.954 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 20.6 tp10 -55.82 -29.33 59.6 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.214 -0.448 . . . . 71.51 110.877 -179.859 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 71.7 mtp -75.55 -59.48 2.73 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.144 -0.48 . . . . 73.04 110.903 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.54 HG13 ' HB2' ' A' ' 102' ' ' ALA . 35.9 mm -53.93 -35.7 28.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.243 -0.435 . . . . 61.33 111.165 179.898 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 56.8 ttt180 -63.49 -31.85 73.13 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.152 -0.476 . . . . 73.13 110.915 179.932 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -74.66 -52.37 11.83 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.139 -0.482 . . . . 74.33 110.864 -179.892 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.673 ' HB3' HG22 ' A' ' 136' ' ' VAL . . . -65.23 -34.49 78.48 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.102 -0.499 . . . . 55.43 111.099 179.925 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 49.4 t0 -68.45 86.74 0.3 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.26 -0.427 . . . . 70.43 110.864 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 55.2 mt -79.83 -46.13 22.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.166 -0.47 . . . . 72.14 111.141 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 21.3 p30 -72.8 -8.74 56.94 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.181 -0.463 . . . . 65.54 110.875 179.864 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 62.76 42.59 99.66 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.703 -0.761 . . . . 74.13 112.476 -179.917 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 34.6 p-10 -87.58 -16.0 35.8 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.864 0.364 . . . . 71.34 110.919 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 104.12 2.37 45.11 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.745 -0.741 . . . . 74.44 112.431 -179.988 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 4.0 tt0 -149.16 172.27 15.09 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.901 0.382 . . . . 73.41 110.894 -179.921 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 136' ' ' VAL . . . . . 0.673 HG22 ' HB3' ' A' ' 128' ' ' ALA . 99.3 t -107.33 111.25 34.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.21 -0.45 . . . . 51.22 111.127 179.98 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 19.0 p30 -92.11 165.59 13.08 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.15 -0.477 . . . . 74.15 110.881 -179.993 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 138' ' ' TYR . . . . . 0.43 ' O ' HG23 ' A' ' 142' ' ' VAL . 37.0 t80 -52.01 -46.89 65.15 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.162 -0.472 . . . . 64.33 110.983 -179.919 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 15.3 tt0 -51.94 -42.14 62.6 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.077 -0.51 . . . . 65.34 110.943 179.965 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 23.7 mt-10 -76.52 -34.27 58.58 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.108 -0.497 . . . . 71.41 110.92 -179.951 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 141' ' ' PHE . . . . . 0.462 ' CE1' HG23 ' A' ' 85' ' ' ILE . 43.2 t80 -65.74 -38.93 90.48 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.121 -0.49 . . . . 54.42 110.855 -179.897 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 142' ' ' VAL . . . . . 0.43 HG23 ' O ' ' A' ' 138' ' ' TYR . 98.9 t -71.34 -40.6 73.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.121 -0.491 . . . . 64.3 111.123 -179.989 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 24.4 tt0 -70.83 -45.31 64.78 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.173 -0.467 . . . . 61.1 110.911 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 11.4 tpt -65.0 -26.2 68.19 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.172 -0.467 . . . . 73.05 110.87 180.0 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 145' ' ' MET . . . . . 0.447 ' HE1' HG22 ' M' ' 19' ' ' ILE . 6.4 ttm -87.61 -39.47 15.04 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.25 -0.432 . . . . 64.53 110.887 179.916 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 146' ' ' THR . . . . . 0.73 HG21 ' OD2' ' A' ' 50' ' ' ASP . 2.6 m -96.6 21.31 9.5 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.197 -0.456 . . . . 72.43 111.113 -179.87 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -51.7 143.36 12.91 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.235 -0.438 . . . . 64.15 111.118 179.807 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 18.9 tptm . . . . . 0 C--N 1.329 -0.295 0 CA-C-N 116.234 -0.439 . . . . 71.31 110.949 179.935 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' M' M ' 8' ' ' LEU . . . . . . . . . . . . . 19.7 tp . . . . . 0 C--O 1.231 0.086 0 CA-C-O 120.821 0.343 . . . . 65.1 110.9 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' M' M ' 9' ' ' SER . . . . . . . . . . . . . 6.2 t 53.44 87.0 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.138 -0.483 . . . . 73.1 110.868 -179.945 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' M' M ' 10' ' ' GLY . . . . . . . . . . . . . . . -82.18 -113.16 0.43 Allowed Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.783 -0.722 . . . . 73.25 112.45 -179.964 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' M' M ' 11' ' ' GLY . . . . . . . . . . . . . . . 106.34 -30.65 9.25 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.688 -0.768 . . . . 73.3 112.484 -179.891 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' M' M ' 12' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -111.53 -179.12 3.62 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.895 0.378 . . . . 74.23 110.882 -179.852 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' M' M ' 13' ' ' LEU . . . . . 0.703 HD23 ' CD1' ' M' ' 16' ' ' TRP . 28.8 tp -63.88 136.33 57.29 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.179 -0.464 . . . . 75.14 110.889 -179.937 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' M' M ' 14' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -84.02 -27.81 28.11 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.192 -0.458 . . . . 70.44 110.878 179.829 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' M' M ' 15' ' ' LYS . . . . . . . . . . . . . 44.7 mttp -60.16 -56.88 16.12 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.212 -0.449 . . . . 62.45 110.888 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' M' M ' 16' ' ' TRP . . . . . 0.703 ' CD1' HD23 ' M' ' 13' ' ' LEU . 10.2 m95 -54.09 -39.03 65.96 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.241 -0.436 . . . . 71.02 110.919 179.923 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' M' M ' 17' ' ' GLU . . . . . . . . . . . . . 15.3 tm-20 -56.9 -27.8 61.15 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.227 -0.442 . . . . 74.42 110.872 -179.929 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' M' M ' 18' ' ' LYS . . . . . 0.434 ' HE2' HD13 ' A' ' 112' ' ' LEU . 6.9 ttpm? -73.45 -26.95 61.16 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.153 -0.476 . . . . 62.1 110.913 179.953 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' M' M ' 19' ' ' ILE . . . . . 0.447 HG22 ' HE1' ' A' ' 145' ' ' MET . 27.6 mt -93.02 -23.45 5.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.25 -0.432 . . . . 64.3 111.169 179.848 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' M' M ' 20' ' ' ARG . . . . . . . . . . . . . 25.5 ttp85 -52.07 -38.35 56.86 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.193 -0.458 . . . . 74.11 110.846 179.972 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' M' M ' 21' ' ' LEU . . . . . . . . . . . . . 6.1 mt 58.95 176.65 0.07 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.231 -0.44 . . . . 74.31 110.951 -179.979 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' M' M ' 22' ' ' ARG . . . . . . . . . . . . . 16.7 ttt180 -175.94 64.91 0.23 Allowed Pre-proline 0 C--N 1.328 -0.329 0 CA-C-O 121.672 0.748 . . . . 64.14 110.9 179.942 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' M' M ' 23' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.74 -48.38 0.74 Allowed 'Trans proline' 0 C--N 1.342 0.187 0 C-N-CA 122.753 2.302 . . . . 75.54 112.314 -179.987 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' M' M ' 24' ' ' GLY . . . . . . . . . . . . . . . 59.73 96.36 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.748 -0.739 . . . . 72.41 112.449 -179.983 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' M' M ' 25' ' ' GLY . . . . . . . . . . . . . . . -157.39 -148.65 5.18 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.743 -0.741 . . . . 51.42 112.512 -179.948 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' M' M ' 26' ' ' LYS . . . . . . . . . . . . . 3.0 mtpm? -137.34 136.95 38.41 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.901 0.381 . . . . 74.42 110.908 179.981 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' M' M ' 27' ' ' LYS . . . . . . . . . . . . . 4.6 ttmm -156.91 -72.71 0.1 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.196 -0.456 . . . . 65.52 110.888 179.924 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' M' M ' 28' ' ' GLN . . . . . . . . . . . . . 2.4 mm100 -147.57 179.66 7.52 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.243 -0.435 . . . . 73.53 110.889 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' M' M ' 29' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -104.05 -177.34 3.34 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.191 -0.459 . . . . 64.33 110.907 -179.835 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' M' M ' 30' ' ' LYS . . . . . 0.427 ' O ' ' HE3' ' A' ' 51' ' ' MET . 0.5 OUTLIER -147.46 49.87 1.08 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.116 -0.493 . . . . 74.14 110.896 179.908 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' M' M ' 31' ' ' LEU . . . . . 0.622 HD13 ' HE2' ' A' ' 51' ' ' MET . 10.9 tp -147.95 -46.56 0.16 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.253 -0.431 . . . . 70.41 110.898 179.984 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' M' M ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.45 -32.83 8.31 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.169 -0.469 . . . . 64.43 110.919 179.866 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' M' M ' 33' ' ' HIS . . . . . . . . . . . . . 77.6 t60 -47.99 -47.17 33.23 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.226 -0.443 . . . . 72.41 110.846 179.919 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' M' M ' 34' ' ' ILE . . . . . 0.501 ' H ' HD12 ' M' ' 34' ' ' ILE . 3.6 mp -51.73 -38.75 22.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.169 -0.469 . . . . 71.43 111.137 179.967 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' M' M ' 35' ' ' VAL . . . . . . . . . . . . . 47.1 t -49.01 -39.63 12.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.203 -0.453 . . . . 74.2 111.138 179.826 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' M' M ' 36' ' ' TRP . . . . . . . . . . . . . 20.9 m0 -59.19 -40.21 85.03 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.197 -0.456 . . . . 73.31 110.923 179.972 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' M' M ' 37' ' ' ALA . . . . . 0.992 ' HB3' HD13 ' A' ' 39' ' ' LEU . . . -63.01 -18.77 63.68 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.231 -0.44 . . . . 51.41 111.09 179.912 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' M' M ' 38' ' ' SER . . . . . . . . . . . . . 5.0 m -64.92 -17.8 64.66 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.207 -0.451 . . . . 64.13 110.886 -179.803 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' M' M ' 39' ' ' ARG . . . . . . . . . . . . . 52.3 mtp180 -52.12 -29.2 20.77 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.123 -0.49 . . . . 70.04 110.88 -179.931 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' M' M ' 40' ' ' GLU . . . . . . . . . . . . . 17.7 tp10 -90.05 -48.08 7.42 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.205 -0.452 . . . . 71.3 110.887 -179.955 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' M' M ' 41' ' ' LEU . . . . . 0.632 HD21 ' OG ' ' A' ' 38' ' ' SER . 6.8 mt -56.56 132.36 51.38 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.132 -0.485 . . . . 74.3 110.9 -179.958 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' M' M ' 42' ' ' GLU . . . . . . . . . . . . . 69.3 mt-10 -134.6 60.43 1.7 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.224 -0.444 . . . . 75.03 110.909 179.864 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' M' M ' 43' ' ' ARG . . . . . . . . . . . . . 26.8 mmt85 . . . . . 0 C--N 1.329 -0.319 0 CA-C-N 116.171 -0.468 . . . . 75.43 110.868 -179.917 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 241' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 262' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 301' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 322' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.457 -0.107 0 CA-C-O 120.793 0.33 . . . . 61.11 111.09 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -161.36 178.34 9.28 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.207 -0.451 . . . . 74.34 110.876 179.923 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 2.5 tp-100 58.29 94.05 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.181 -0.463 . . . . 75.22 110.906 -179.889 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -65.35 109.38 2.25 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.163 -0.471 . . . . 73.42 110.936 -180.0 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 77.6 p -94.11 175.86 6.54 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.201 -0.454 . . . . 71.13 111.166 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 22.8 tt0 -60.28 -38.69 84.35 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.209 -0.451 . . . . 62.12 110.875 -179.975 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 28.0 tt0 -68.51 -33.27 73.85 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.129 -0.487 . . . . 72.5 110.842 -179.89 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 32.4 tt0 -78.03 -41.2 36.48 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.161 -0.472 . . . . 74.03 110.921 -179.904 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 54.3 mt -72.69 -45.8 56.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.184 -0.462 . . . . 73.24 111.105 179.962 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -52.0 -29.54 21.26 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.23 -0.441 . . . . 74.04 111.087 179.818 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 41.3 tp10 -73.87 -38.39 64.45 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.263 -0.426 . . . . 72.41 110.93 -179.958 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 30.3 m-85 -75.82 -46.02 32.76 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.108 -0.496 . . . . 73.14 110.854 -179.933 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 35.1 ttmt -60.63 -35.47 76.26 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.175 -0.466 . . . . 72.31 110.955 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 23.0 mt-10 -58.62 -37.73 76.51 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.228 -0.442 . . . . 75.4 110.911 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.418 ' HB1' HG13 ' M' ' 35' ' ' VAL . . . -71.43 -43.94 65.79 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.126 -0.488 . . . . 70.43 111.096 179.913 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 92.6 t80 -55.49 -53.97 49.76 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.254 -0.43 . . . . 72.5 110.868 -179.912 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 12.6 t -52.43 -30.41 29.34 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.177 -0.465 . . . . 72.41 110.887 -179.799 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.627 HD23 ' HB3' ' M' ' 38' ' ' SER . 15.6 tp -65.71 -42.19 91.43 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.099 -0.5 . . . . 54.45 110.878 -179.968 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 43.1 m-85 -75.43 -25.46 57.51 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.181 -0.463 . . . . 70.0 110.866 179.948 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 20.9 t0 -84.02 98.54 9.89 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.167 -0.469 . . . . 64.14 110.85 179.994 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 15.7 ttmm -71.11 -55.51 8.04 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.167 -0.47 . . . . 71.01 110.906 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 22.5 p-10 -72.19 -10.15 59.4 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.225 -0.443 . . . . 74.12 110.833 179.909 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 51.82 42.14 52.53 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.777 -0.725 . . . . 74.51 112.506 -179.9 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 27.5 p-10 -88.44 -15.8 34.48 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.824 0.345 . . . . 73.34 110.814 -179.967 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 104.98 -7.14 44.17 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.776 -0.726 . . . . 72.5 112.496 -179.907 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 2.8 p -131.79 130.83 42.34 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.737 0.304 . . . . 75.23 111.168 -179.862 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.58 HG21 HD23 ' A' ' 32' ' ' LEU . 28.7 mt -93.69 120.32 42.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.191 -0.459 . . . . 72.2 111.143 179.91 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.601 HG22 ' CG2' ' A' ' 62' ' ' THR . 20.3 p -101.43 175.46 5.56 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.164 -0.471 . . . . 72.02 111.146 179.948 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 33.7 p -62.36 -24.97 67.66 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.185 -0.461 . . . . 74.4 111.146 -179.97 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 31.3 mttm -73.09 -50.1 24.78 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.215 -0.448 . . . . 72.55 110.898 179.901 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.554 ' O ' HG23 ' A' ' 35' ' ' VAL . 46.2 mt-10 -73.74 -32.69 63.98 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.255 -0.43 . . . . 74.53 110.883 179.975 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.581 HD13 ' O ' ' A' ' 32' ' ' LEU . 0.9 OUTLIER -73.51 -40.87 63.71 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.16 -0.473 . . . . 72.15 110.919 179.99 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -71.73 -40.52 58.3 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.736 -0.745 . . . . 64.25 112.51 179.923 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 96.7 m -59.6 -56.09 26.24 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.825 0.345 . . . . 75.12 111.107 -179.852 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.554 HG23 ' O ' ' A' ' 31' ' ' GLU . 97.4 t -51.44 -50.11 29.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.247 -0.433 . . . . 72.52 111.139 179.908 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 3.0 mtp -52.07 -32.1 33.22 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.125 -0.489 . . . . 74.3 110.901 179.918 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 40.8 ttt-85 -64.4 -48.23 76.19 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.207 -0.451 . . . . 63.53 110.868 -179.919 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' SER . . . . . 0.688 ' OG ' HD11 ' M' ' 41' ' ' LEU . 2.2 p -59.42 -28.81 67.27 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.176 -0.466 . . . . 15.35 110.834 -179.775 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 1.029 HD13 ' HB3' ' M' ' 37' ' ' ALA . 32.8 mt -80.32 -16.27 54.98 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.183 -0.462 . . . . 73.24 110.928 179.994 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 101.58 27.11 7.31 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.721 -0.752 . . . . 62.43 112.487 179.927 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 5.2 mt-30 -119.69 135.42 54.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.802 0.334 . . . . 62.5 110.894 -179.845 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 32.5 t-20 -109.79 76.76 0.97 Allowed Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 121.627 0.727 . . . . 63.32 110.914 -179.949 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.75 149.73 67.35 Favored 'Trans proline' 0 C--O 1.232 0.191 0 C-N-CA 122.634 2.223 . . . . 63.41 112.375 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 20.9 p -99.15 176.77 5.43 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.23 -0.441 . . . . 74.54 111.109 -179.925 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 36.1 mm-40 -64.83 -47.02 79.47 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.185 -0.461 . . . . 74.44 110.949 179.94 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.4 -38.94 65.43 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.158 -0.474 . . . . 71.43 111.047 179.94 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 13.2 tt0 -55.8 -52.65 63.24 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.267 -0.424 . . . . 75.02 110.896 -179.916 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.457 ' CD2' HD12 ' A' ' 32' ' ' LEU . 9.2 mt -57.59 -52.19 66.43 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.15 -0.477 . . . . 63.54 110.948 179.985 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.2 mm-40 -56.97 -28.5 62.36 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.21 -0.45 . . . . 72.12 110.88 179.933 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -63.98 -49.57 71.97 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.199 -0.455 . . . . 63.01 110.881 179.998 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' MET . . . . . 0.64 ' SD ' HD13 ' M' ' 31' ' ' LEU . 6.7 ptp -75.71 -37.49 59.4 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.233 -0.439 . . . . 74.41 110.878 179.985 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 79.2 mt -65.31 -47.49 86.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.23 -0.441 . . . . 72.44 111.138 179.984 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 85.2 m-20 -58.39 -33.58 69.78 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.147 -0.479 . . . . 73.34 110.895 179.921 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 15.0 mm-40 -62.41 -51.02 69.2 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.178 -0.464 . . . . 73.13 110.901 -179.997 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.401 HG13 ' CE1' ' M' ' 29' ' ' TYR . 17.6 m -77.98 -15.0 14.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.125 -0.489 . . . . 62.24 111.143 179.97 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 39.1 t0 -66.75 95.19 0.34 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.172 -0.467 . . . . 64.53 110.89 179.877 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.26 -35.3 17.36 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.166 -0.47 . . . . 73.43 111.101 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -88.22 -0.13 56.76 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.199 -0.455 . . . . 70.01 110.852 -179.998 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 52.79 58.95 9.99 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.726 -0.749 . . . . 35.25 112.495 -179.954 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 51.8 p-10 -114.63 -15.78 11.92 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.836 0.351 . . . . 64.15 110.888 -179.899 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 93.25 18.54 38.91 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.755 -0.736 . . . . 74.3 112.471 179.961 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' THR . . . . . 0.601 ' CG2' HG22 ' A' ' 28' ' ' THR . 63.9 p -150.76 170.77 18.44 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.754 0.312 . . . . 73.43 111.153 -179.855 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 21.5 mt -102.47 109.53 26.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.257 -0.429 . . . . 74.31 111.132 179.942 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -74.13 -172.86 1.48 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.18 -0.464 . . . . 73.3 110.869 179.866 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.54 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 2.5 t80 -65.38 -58.05 13.16 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.647 0.737 . . . . 73.25 110.908 -179.923 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 66' ' ' PRO . . . . . 0.54 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 53.2 Cg_endo -69.75 -25.92 28.14 Favored 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.725 2.283 . . . . 65.44 112.317 -179.97 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -63.23 -39.98 96.17 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.211 -0.45 . . . . 74.15 110.879 -179.956 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 44.9 t80 -74.5 -35.94 63.23 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.132 -0.485 . . . . 74.42 110.883 -179.909 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 21.9 tp -71.03 -54.14 12.24 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.183 -0.462 . . . . 72.42 110.879 -179.978 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 13.4 t -51.69 -30.01 20.45 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.202 -0.453 . . . . 61.03 111.168 179.904 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 37.7 ttp -59.72 -41.95 91.99 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.205 -0.452 . . . . 64.52 110.842 179.975 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 3.5 mtt -79.84 -28.87 40.03 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.228 -0.442 . . . . 73.33 110.865 179.952 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -74.85 -28.48 60.69 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.273 -0.421 . . . . 63.53 111.111 179.908 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 50.5 ttm-85 -66.19 -19.15 65.74 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.215 -0.448 . . . . 64.24 110.906 -179.919 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 15.8 pttp -51.45 -30.62 20.23 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.15 -0.477 . . . . 72.13 110.87 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 18.9 mtt -84.16 -32.58 24.55 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.26 -0.427 . . . . 70.41 110.898 179.869 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 31.0 tttt -68.79 174.42 4.37 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.233 -0.44 . . . . 72.42 110.903 179.937 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -111.51 77.14 1.02 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.176 -0.465 . . . . 74.04 110.87 179.849 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 7.7 p -154.43 33.35 0.42 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.187 -0.46 . . . . 73.33 111.149 -179.888 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -116.18 -25.93 7.41 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.21 -0.45 . . . . 71.31 110.851 179.946 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 81' ' ' SER . . . . . 0.554 ' O ' HD12 ' A' ' 85' ' ' ILE . 50.3 m -52.16 -44.25 64.49 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.189 -0.46 . . . . 65.41 110.841 -179.744 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 8.7 tm-20 -54.3 -27.51 35.99 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.139 -0.482 . . . . 73.33 110.88 -179.934 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 12.8 tp10 -67.64 -39.21 84.64 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.146 -0.479 . . . . 73.14 110.899 -179.941 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -58.01 -37.23 73.93 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.174 -0.466 . . . . 72.52 110.862 -179.911 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.596 HG21 HG22 ' A' ' 142' ' ' VAL . 5.0 mp -75.12 -50.04 26.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.154 -0.476 . . . . 73.31 111.117 -179.996 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 20.4 ttt-85 -61.68 -28.23 69.25 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.188 -0.46 . . . . 65.41 110.865 -179.992 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.672 ' O ' HG23 ' A' ' 91' ' ' VAL . 7.9 mm-40 -68.19 -48.33 65.54 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.193 -0.458 . . . . 75.32 110.932 -179.997 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 88' ' ' ALA . . . . . 0.75 ' HB1' ' CE2' ' A' ' 92' ' ' PHE . . . -74.04 -35.34 64.31 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.149 -0.478 . . . . 70.25 111.069 179.96 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 4.4 t80 -53.71 -47.78 70.2 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.256 -0.429 . . . . 75.13 110.863 -179.897 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 7.5 ptm180 -69.04 -25.95 64.73 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.131 -0.486 . . . . 73.43 110.875 -179.926 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 91' ' ' VAL . . . . . 0.672 HG23 ' O ' ' A' ' 87' ' ' GLU . 96.5 t -78.12 -27.4 14.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.194 -0.457 . . . . 74.5 111.131 179.988 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.75 ' CE2' ' HB1' ' A' ' 88' ' ' ALA . 21.9 m-85 -94.66 -26.14 16.45 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.134 -0.485 . . . . 72.51 110.888 -179.992 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 32.7 t0 -73.98 95.1 2.44 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.161 -0.472 . . . . 72.14 110.866 179.982 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 42.9 mmtt -78.68 -52.54 8.27 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.199 -0.455 . . . . 63.25 110.886 -180.0 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 52.1 p-10 -72.44 -9.15 58.17 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.211 -0.449 . . . . 64.45 110.838 179.917 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 59.79 28.37 65.59 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.709 -0.758 . . . . 73.3 112.487 -179.934 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 35.4 p-10 -81.77 -16.14 51.98 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.857 0.36 . . . . 50.23 110.881 -179.897 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 88.73 18.68 54.11 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.717 -0.754 . . . . 73.45 112.543 -179.952 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 23.6 m-85 -142.83 153.64 43.4 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.898 0.38 . . . . 72.13 110.918 -179.824 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.488 HD12 ' HD2' ' A' ' 141' ' ' PHE . 78.1 mt -119.25 127.04 75.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.089 -0.505 . . . . 72.22 111.133 179.954 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 6.4 p -112.44 -176.19 2.86 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.184 -0.462 . . . . 40.22 110.882 -179.946 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 102' ' ' ALA . . . . . 0.55 ' HB2' HG13 ' A' ' 125' ' ' ILE . . . -74.31 -27.49 60.73 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.149 -0.478 . . . . 72.34 111.144 179.9 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -72.01 -47.68 50.1 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.21 -0.45 . . . . 71.34 111.09 179.951 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -67.78 -46.07 73.02 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.209 -0.45 . . . . 70.41 110.897 -179.922 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.65 HD21 ' HE2' ' A' ' 124' ' ' MET . 21.2 tp -52.87 -39.56 62.74 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.109 -0.496 . . . . 75.53 110.936 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 106' ' ' ARG . . . . . 0.443 ' O ' HG23 ' A' ' 110' ' ' THR . 63.0 ttp85 -55.46 -38.7 69.41 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.177 -0.465 . . . . 74.32 110.874 179.939 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 40.8 t60 -66.83 -34.37 77.67 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.171 -0.468 . . . . 72.15 110.862 -179.989 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 88.6 t -72.0 -51.18 32.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.21 -0.45 . . . . 74.2 111.132 179.955 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 1.3 mmt -60.61 -43.72 97.12 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.184 -0.462 . . . . 75.24 110.869 179.929 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 110' ' ' THR . . . . . 0.443 HG23 ' O ' ' A' ' 106' ' ' ARG . 9.7 p -54.03 -27.26 31.02 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.235 -0.439 . . . . 74.25 111.137 -179.929 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.9 t30 -70.78 -31.68 68.54 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.223 -0.444 . . . . 62.33 110.885 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.608 HD13 ' HE2' ' M' ' 18' ' ' LYS . 8.2 mt -71.19 -26.21 62.86 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.201 -0.454 . . . . 60.02 110.89 179.967 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 100.89 32.62 5.29 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.752 -0.737 . . . . 71.3 112.5 179.902 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 13.8 mm-40 -113.78 119.98 39.2 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.908 0.385 . . . . 73.1 110.896 -179.88 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 115' ' ' LYS . . . . . 0.466 ' O ' HD23 ' A' ' 116' ' ' LEU . 7.7 tptm -68.89 97.95 0.89 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.125 -0.488 . . . . 72.32 110.902 179.973 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.59 HD22 ' HG2' ' A' ' 120' ' ' GLU . 16.4 mt -133.01 119.41 20.03 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.244 -0.434 . . . . 73.22 110.896 179.929 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 117' ' ' THR . . . . . 0.415 ' O ' HG23 ' A' ' 121' ' ' VAL . 82.2 p -84.22 174.31 10.3 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.183 -0.462 . . . . 62.32 111.126 179.966 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -52.68 -42.93 65.22 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.23 -0.441 . . . . 70.51 110.884 179.881 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -62.29 -33.39 74.56 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.194 -0.457 . . . . 63.34 110.862 -179.882 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 120' ' ' GLU . . . . . 0.59 ' HG2' HD22 ' A' ' 116' ' ' LEU . 6.2 tp10 -70.84 -39.42 72.97 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.151 -0.477 . . . . 74.01 110.867 -179.91 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.474 HG11 ' O ' ' A' ' 102' ' ' ALA . 21.9 t -65.25 -31.27 53.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.173 -0.467 . . . . 74.24 111.143 179.958 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 20.0 t0 -51.95 -46.11 64.62 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.133 -0.485 . . . . 73.43 110.905 179.919 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 123' ' ' GLU . . . . . 0.469 ' HG2' HD23 ' M' ' 13' ' ' LEU . 13.3 tp10 -56.57 -29.6 62.21 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.198 -0.455 . . . . 73.4 110.878 -179.947 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 124' ' ' MET . . . . . 0.65 ' HE2' HD21 ' A' ' 105' ' ' LEU . 55.7 mtp -75.42 -59.51 2.72 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.171 -0.468 . . . . 73.32 110.913 179.957 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.55 HG13 ' HB2' ' A' ' 102' ' ' ALA . 35.9 mm -53.95 -35.69 28.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.216 -0.447 . . . . 75.11 111.119 179.948 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 1.6 tmt_? -63.33 -31.9 73.17 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.137 -0.483 . . . . 75.42 110.904 179.939 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -74.8 -52.39 11.58 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.203 -0.453 . . . . 64.25 110.887 -179.947 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.652 ' HB3' HG22 ' A' ' 136' ' ' VAL . . . -65.13 -34.44 78.4 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.19 -0.459 . . . . 62.31 111.081 179.957 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 49.3 t0 -68.38 86.73 0.29 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.247 -0.433 . . . . 74.05 110.853 179.981 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 61.1 mt -79.86 -46.21 22.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.228 -0.442 . . . . 73.45 111.17 179.982 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 21.2 p30 -72.8 -8.67 56.6 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.173 -0.467 . . . . 73.53 110.862 179.815 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 62.81 43.05 99.52 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.751 -0.737 . . . . 63.11 112.488 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 34.5 p-10 -88.3 -15.93 34.43 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.847 0.356 . . . . 71.33 110.907 -179.991 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 103.91 2.45 45.81 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.701 -0.761 . . . . 42.25 112.491 -179.957 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 4.1 tt0 -149.19 172.26 15.11 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.816 0.341 . . . . 72.44 110.894 -179.862 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 136' ' ' VAL . . . . . 0.652 HG22 ' HB3' ' A' ' 128' ' ' ALA . 86.5 t -107.84 111.91 37.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.192 -0.458 . . . . 71.11 111.135 179.939 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 43.6 p-10 -92.52 166.61 12.43 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.183 -0.462 . . . . 65.43 110.908 179.97 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 138' ' ' TYR . . . . . 0.511 ' O ' HG23 ' A' ' 142' ' ' VAL . 52.1 t80 -51.98 -46.79 64.98 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.169 -0.469 . . . . 74.44 110.949 -179.948 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -52.01 -43.77 63.82 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.116 -0.493 . . . . 75.53 110.847 -179.947 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 24.1 mt-10 -75.11 -31.86 61.24 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.204 -0.453 . . . . 62.51 110.877 -179.911 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 141' ' ' PHE . . . . . 0.589 ' CD1' HG23 ' A' ' 85' ' ' ILE . 6.2 t80 -68.07 -35.35 78.06 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.114 -0.494 . . . . 75.41 110.902 -179.895 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 142' ' ' VAL . . . . . 0.596 HG22 HG21 ' A' ' 85' ' ' ILE . 92.7 t -71.23 -42.14 74.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.161 -0.472 . . . . 75.0 111.15 179.932 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 18.4 tt0 -71.07 -28.55 64.43 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.156 -0.475 . . . . 62.55 110.89 -179.993 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 6.2 tpt -74.0 -55.24 6.38 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.211 -0.449 . . . . 75.01 110.911 179.927 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 11.9 ttm -66.09 -33.87 76.77 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.219 -0.446 . . . . 75.31 110.912 179.927 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 2.0 m -99.4 21.31 12.27 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.235 -0.439 . . . . 61.11 111.177 -179.961 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -51.94 126.34 17.99 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.143 -0.48 . . . . 71.03 111.081 179.88 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.286 0 CA-C-N 116.202 -0.454 . . . . 71.03 110.883 179.971 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' M' M ' 8' ' ' LEU . . . . . . . . . . . . . 4.5 mm? . . . . . 0 C--O 1.232 0.15 0 CA-C-O 120.839 0.352 . . . . 73.14 110.895 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' M' M ' 9' ' ' SER . . . . . . . . . . . . . 7.9 t 61.32 175.98 0.11 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.195 -0.457 . . . . 71.1 110.837 -179.952 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' M' M ' 10' ' ' GLY . . . . . . . . . . . . . . . 148.62 -36.97 1.06 Allowed Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.759 -0.734 . . . . 70.45 112.46 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' M' M ' 11' ' ' GLY . . . . . . . . . . . . . . . -101.94 48.64 1.07 Allowed Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.752 -0.737 . . . . 74.51 112.499 -179.907 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' M' M ' 12' ' ' GLU . . . . . . . . . . . . . 81.3 mm-40 -149.05 -174.36 4.62 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.928 0.394 . . . . 75.23 110.898 -179.849 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' M' M ' 13' ' ' LEU . . . . . 0.469 HD23 ' HG2' ' A' ' 123' ' ' GLU . 0.9 OUTLIER -87.64 75.8 8.98 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.18 -0.464 . . . . 73.1 110.897 -179.974 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' M' M ' 14' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -102.35 25.22 9.22 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.193 -0.458 . . . . 64.32 110.887 179.811 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' M' M ' 15' ' ' LYS . . . . . . . . . . . . . 7.4 mtmp? -75.36 -44.42 45.2 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.146 -0.479 . . . . 71.3 110.881 -179.998 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' M' M ' 16' ' ' TRP . . . . . 0.5 ' CE3' HD12 ' M' ' 19' ' ' ILE . 19.2 m95 -51.99 -38.95 58.53 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.184 -0.462 . . . . 71.53 110.978 179.917 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' M' M ' 17' ' ' GLU . . . . . . . . . . . . . 30.9 tp10 -56.17 -32.21 64.12 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.205 -0.452 . . . . 75.14 110.833 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' M' M ' 18' ' ' LYS . . . . . 0.608 ' HE2' HD13 ' A' ' 112' ' ' LEU . 6.4 ttpm? -63.36 -29.22 70.56 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.178 -0.464 . . . . 74.54 110.923 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' M' M ' 19' ' ' ILE . . . . . 0.5 HD12 ' CE3' ' M' ' 16' ' ' TRP . 28.8 mt -86.48 -25.13 6.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.192 -0.458 . . . . 53.51 111.166 179.86 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' M' M ' 20' ' ' ARG . . . . . . . . . . . . . 22.6 ttp180 -68.73 -26.4 65.24 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.17 -0.468 . . . . 75.15 110.863 179.984 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' M' M ' 21' ' ' LEU . . . . . . . . . . . . . 6.9 mt 63.03 -171.68 0.17 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.186 -0.461 . . . . 51.21 110.912 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' M' M ' 22' ' ' ARG . . . . . . . . . . . . . 27.9 mtm180 -63.18 148.73 92.46 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.557 0.694 . . . . 73.4 110.924 179.936 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' M' M ' 23' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.69 140.72 43.65 Favored 'Trans proline' 0 C--N 1.341 0.138 0 C-N-CA 122.665 2.244 . . . . 75.12 112.375 179.978 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' M' M ' 24' ' ' GLY . . . . . . . . . . . . . . . -171.61 -126.15 0.87 Allowed Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.754 -0.736 . . . . 35.42 112.504 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' M' M ' 25' ' ' GLY . . . . . . . . . . . . . . . 76.95 90.88 0.26 Allowed Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.746 -0.74 . . . . 42.44 112.45 -179.923 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' M' M ' 26' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -173.99 -38.27 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.839 0.352 . . . . 74.03 110.861 -179.99 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' M' M ' 27' ' ' LYS . . . . . . . . . . . . . 79.3 tttt -140.41 80.55 1.76 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.231 -0.44 . . . . 64.54 110.879 179.925 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' M' M ' 28' ' ' GLN . . . . . . . . . . . . . 21.4 mt-30 -143.37 98.0 3.18 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.197 -0.456 . . . . 72.31 110.948 179.962 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' M' M ' 29' ' ' TYR . . . . . 0.401 ' CE1' HG13 ' A' ' 55' ' ' VAL . 0.2 OUTLIER -115.77 -22.37 9.17 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.204 -0.453 . . . . 75.32 110.972 -179.878 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' M' M ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 63.35 22.1 13.12 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.089 -0.505 . . . . 74.51 110.889 179.878 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' M' M ' 31' ' ' LEU . . . . . 0.64 HD13 ' SD ' ' A' ' 51' ' ' MET . 13.7 tp -137.25 -51.39 0.65 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.196 -0.456 . . . . 53.21 110.911 179.924 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' M' M ' 32' ' ' LYS . . . . . . . . . . . . . 3.0 ptpp? -49.55 -39.14 33.74 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.219 -0.446 . . . . 72.54 110.901 179.81 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' M' M ' 33' ' ' HIS . . . . . . . . . . . . . 10.7 t-160 -50.09 -41.26 47.92 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.227 -0.442 . . . . 73.13 110.861 179.925 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' M' M ' 34' ' ' ILE . . . . . 0.444 HD12 HD12 ' M' ' 31' ' ' LEU . 65.0 mt -50.37 -39.32 16.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.19 -0.459 . . . . 63.32 111.148 179.989 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' M' M ' 35' ' ' VAL . . . . . 0.418 HG13 ' HB1' ' A' ' 15' ' ' ALA . 61.5 t -49.16 -40.28 13.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.192 -0.458 . . . . 73.55 111.121 179.824 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' M' M ' 36' ' ' TRP . . . . . . . . . . . . . 21.7 m0 -58.93 -39.52 81.83 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.122 -0.49 . . . . 74.42 110.927 179.985 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' M' M ' 37' ' ' ALA . . . . . 1.029 ' HB3' HD13 ' A' ' 39' ' ' LEU . . . -64.13 -18.61 64.59 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.218 -0.446 . . . . 34.21 111.117 179.869 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' M' M ' 38' ' ' SER . . . . . 0.627 ' HB3' HD23 ' A' ' 18' ' ' LEU . 0.8 OUTLIER -72.18 -17.98 61.9 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.237 -0.438 . . . . 74.15 110.872 -179.8 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' M' M ' 39' ' ' ARG . . . . . . . . . . . . . 4.6 tpt85 -60.75 -25.47 66.51 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.116 -0.493 . . . . 62.42 110.896 -179.914 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' M' M ' 40' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 -78.04 -47.99 17.12 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.131 -0.486 . . . . 62.21 110.874 -179.9 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' M' M ' 41' ' ' LEU . . . . . 0.688 HD11 ' OG ' ' A' ' 38' ' ' SER . 17.3 mt -52.98 119.94 5.25 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.163 -0.471 . . . . 73.12 110.93 179.98 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' M' M ' 42' ' ' GLU . . . . . . . . . . . . . 14.0 mt-10 71.63 -69.47 0.18 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.149 -0.478 . . . . 74.21 110.891 179.915 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' M' M ' 43' ' ' ARG . . . . . . . . . . . . . 57.8 ttt180 . . . . . 0 C--N 1.329 -0.294 0 CA-C-N 116.161 -0.472 . . . . 73.24 110.851 -179.924 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 241' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 262' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 301' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 322' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.801 0.334 . . . . 73.01 111.099 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -122.39 -42.54 2.34 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.23 -0.441 . . . . 62.42 110.869 179.981 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 45.3 tt0 -115.03 110.41 19.55 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.192 -0.458 . . . . 63.44 110.944 -179.934 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.427 HD22 ' CD ' ' A' ' 8' ' ' GLN . 12.2 mt -110.85 137.19 48.81 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.198 -0.455 . . . . 75.33 110.906 -179.968 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -113.72 177.44 4.63 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.227 -0.442 . . . . 74.33 111.099 179.948 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 16.9 tp10 -52.41 -30.19 28.04 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.178 -0.464 . . . . 61.41 110.869 -179.999 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -66.64 -41.45 88.25 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.171 -0.468 . . . . 75.21 110.876 -179.939 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' GLN . . . . . 0.427 ' CD ' HD22 ' A' ' 4' ' ' LEU . 19.4 tt0 -77.97 -40.06 40.5 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.162 -0.472 . . . . 72.31 110.936 -179.96 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 61.7 mt -68.78 -37.3 77.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.192 -0.458 . . . . 55.33 111.115 179.991 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -52.33 -49.85 63.45 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.166 -0.47 . . . . 55.21 111.082 179.852 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 17.0 mm-40 -54.92 -39.91 69.3 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.222 -0.445 . . . . 75.22 110.903 -179.916 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 31.4 m-85 -72.68 -41.2 65.59 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.148 -0.478 . . . . 72.21 110.852 -179.921 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 18.4 ttpp -54.81 -41.69 70.94 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.167 -0.47 . . . . 71.21 110.88 -179.99 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 8.4 tt0 -59.11 -36.12 74.63 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.228 -0.442 . . . . 70.44 110.884 179.948 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -67.91 -49.69 60.44 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.147 -0.478 . . . . 44.23 111.089 179.957 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 57.8 t80 -52.15 -49.52 63.59 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.226 -0.443 . . . . 74.14 110.913 -179.904 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 12.9 t -57.14 -30.39 64.39 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.151 -0.477 . . . . 63.13 110.893 -179.81 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.477 HD23 ' HB3' ' M' ' 38' ' ' SER . 15.7 tp -66.06 -42.2 89.78 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.068 -0.514 . . . . 74.14 110.885 179.984 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.613 ' HA ' HG21 ' A' ' 35' ' ' VAL . 67.6 m-85 -78.02 -24.92 47.72 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.222 -0.445 . . . . 74.31 110.866 179.94 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 14.3 t0 -79.14 98.61 6.63 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.178 -0.464 . . . . 75.43 110.866 179.975 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.448 ' NZ ' HG21 ' A' ' 34' ' ' THR . 9.2 ttmm -66.49 -50.28 63.79 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.201 -0.454 . . . . 63.32 110.895 179.995 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 18.5 p-10 -81.46 -10.09 59.57 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.219 -0.446 . . . . 71.03 110.831 179.908 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 52.04 55.64 20.38 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.73 -0.748 . . . . 24.04 112.508 -179.889 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 29.2 p-10 -111.56 17.74 19.73 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.798 0.332 . . . . 70.22 110.849 -179.968 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 71.68 18.25 77.17 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.753 -0.737 . . . . 43.11 112.529 -179.907 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 22.3 p -145.46 156.53 43.8 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.714 0.292 . . . . 73.51 111.155 -179.85 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.413 HG22 ' HB2' ' A' ' 32' ' ' LEU . 28.8 mt -130.27 125.47 59.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.233 -0.44 . . . . 74.03 111.193 179.924 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.6 HG22 HG21 ' A' ' 62' ' ' THR . 80.9 p -110.53 177.14 4.78 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.206 -0.452 . . . . 70.11 111.168 179.998 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 49.5 p -63.54 -25.47 68.26 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.22 -0.445 . . . . 74.43 111.115 -179.962 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 2.3 tppt? -79.96 -50.17 10.82 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.174 -0.466 . . . . 75.15 110.868 179.94 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 -67.89 -36.97 81.15 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.207 -0.451 . . . . 75.53 110.867 179.996 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.413 ' HB2' HG22 ' A' ' 27' ' ' ILE . 4.1 tt -73.83 -53.58 9.92 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.157 -0.474 . . . . 61.12 110.957 -179.973 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -51.92 -28.4 24.3 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.743 -0.741 . . . . 61.14 112.524 179.83 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.448 HG21 ' NZ ' ' A' ' 21' ' ' LYS . 97.6 m -63.18 -58.99 5.37 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.883 0.373 . . . . 64.22 111.172 -179.866 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.613 HG21 ' HA ' ' A' ' 19' ' ' PHE . 51.6 t -57.72 -34.57 48.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.173 -0.467 . . . . 72.31 111.141 179.891 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 6.3 mmm -59.62 -49.01 79.41 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.158 -0.474 . . . . 73.33 110.874 179.968 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 29.7 ttp180 -57.17 -42.65 81.52 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.236 -0.438 . . . . 75.42 110.872 -179.945 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' SER . . . . . 0.419 ' OG ' HD21 ' M' ' 41' ' ' LEU . 1.6 t -57.91 -25.28 60.64 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.202 -0.454 . . . . 62.51 110.883 -179.814 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.891 HD13 ' HB3' ' M' ' 37' ' ' ALA . 83.3 mt -94.41 -10.39 32.64 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.084 -0.507 . . . . 70.44 110.876 -179.98 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 101.54 -6.63 55.4 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.76 -0.733 . . . . 44.32 112.468 179.93 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 15.8 tp60 -87.39 102.34 14.44 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.833 0.349 . . . . 75.1 110.9 -179.853 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 6.1 t-20 -109.85 76.75 0.98 Allowed Pre-proline 0 C--N 1.33 -0.279 0 CA-C-O 121.574 0.702 . . . . 65.34 110.887 -179.971 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.79 168.0 22.86 Favored 'Trans proline' 0 C--O 1.232 0.187 0 C-N-CA 122.709 2.273 . . . . 71.44 112.351 179.937 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 79.0 p -84.68 161.78 19.94 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.237 -0.438 . . . . 51.24 111.118 -179.949 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 94.1 mt-10 -52.41 -38.9 60.14 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.17 -0.468 . . . . 64.21 110.862 179.983 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.32 -39.28 65.39 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.183 -0.462 . . . . 42.53 111.051 179.957 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -62.09 -47.55 84.13 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.232 -0.44 . . . . 63.24 110.906 -179.923 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 22.0 mt -55.43 -47.48 75.91 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.159 -0.473 . . . . 71.31 110.894 -179.984 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 37.1 tp60 -71.86 -28.1 63.32 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.216 -0.447 . . . . 44.2 110.897 179.938 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -56.21 -49.77 73.14 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.218 -0.446 . . . . 63.33 110.888 179.904 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 6.0 ptp -69.85 -36.28 75.41 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.191 -0.459 . . . . 62.43 110.894 -179.986 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 87.3 mt -63.78 -41.35 92.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.249 -0.432 . . . . 73.31 111.153 179.922 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 34.5 m-20 -70.38 -31.7 69.05 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.18 -0.464 . . . . 73.23 110.907 179.935 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -71.62 -25.09 62.01 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.142 -0.481 . . . . 64.33 110.851 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.493 HG12 ' CE2' ' M' ' 29' ' ' TYR . 29.1 m -106.65 7.2 9.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.196 -0.456 . . . . 52.32 111.119 179.98 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -82.62 99.77 9.77 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.192 -0.458 . . . . 73.21 110.843 179.961 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.4 -33.85 17.76 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.148 -0.478 . . . . 72.2 111.147 179.932 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 2.6 p-10 -92.52 -0.57 57.32 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.199 -0.455 . . . . 75.23 110.869 179.945 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 50.85 60.94 6.5 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.744 -0.741 . . . . 72.11 112.517 -179.899 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 50.9 p-10 -114.55 -15.78 11.97 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.915 0.388 . . . . 61.24 110.901 -179.873 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 95.43 15.71 42.87 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.726 -0.75 . . . . 62.34 112.503 179.963 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' THR . . . . . 0.6 HG21 HG22 ' A' ' 28' ' ' THR . 22.5 p -152.68 175.45 12.81 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.795 0.331 . . . . 71.24 111.157 -179.922 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.57 HG21 ' HD1' ' A' ' 68' ' ' PHE . 27.0 mt -106.83 111.57 36.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.213 -0.449 . . . . 71.32 111.13 179.912 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -77.93 -172.78 2.83 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.158 -0.474 . . . . 72.02 110.856 179.89 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.538 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 2.4 t80 -64.93 -57.94 14.38 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.604 0.716 . . . . 73.14 110.9 -179.895 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 66' ' ' PRO . . . . . 0.538 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 53.8 Cg_endo -69.78 -28.74 24.76 Favored 'Trans proline' 0 C--N 1.341 0.159 0 C-N-CA 122.677 2.251 . . . . 73.43 112.353 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 18.2 mt-10 -60.97 -39.73 90.72 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.188 -0.46 . . . . 72.15 110.875 -179.984 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' PHE . . . . . 0.57 ' HD1' HG21 ' A' ' 63' ' ' ILE . 20.1 t80 -74.3 -36.23 63.72 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.094 -0.503 . . . . 75.33 110.848 -179.864 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 27.7 tp -69.53 -53.82 17.15 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.191 -0.459 . . . . 74.53 110.913 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 14.7 t -53.08 -27.95 22.74 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.193 -0.458 . . . . 61.23 111.134 179.934 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' MET . . . . . 0.488 ' SD ' HG11 ' A' ' 55' ' ' VAL . 42.6 ttp -64.4 -49.9 69.72 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.27 -0.423 . . . . 63.45 110.856 179.914 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 72' ' ' MET . . . . . 0.414 ' HE3' HG11 ' M' ' 35' ' ' VAL . 1.2 mtt -53.33 -44.15 68.24 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.244 -0.435 . . . . 52.32 110.849 179.998 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -74.89 -33.26 62.02 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.229 -0.441 . . . . 61.33 111.109 179.933 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 20.1 tpp180 -62.28 -18.46 61.33 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.201 -0.454 . . . . 74.13 110.836 -179.887 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 13.8 pttp -50.81 -31.05 15.84 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.181 -0.463 . . . . 72.2 110.878 179.954 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 25.5 tpp -58.33 -36.18 73.01 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.254 -0.43 . . . . 63.43 110.866 179.903 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 5.7 tttp -68.79 -169.77 0.19 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.281 -0.418 . . . . 54.34 110.881 179.924 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' ASP . . . . . 0.442 ' O ' HG23 ' A' ' 79' ' ' THR . 16.5 t0 -73.06 130.8 41.13 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.202 -0.454 . . . . 71.22 110.87 179.875 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 79' ' ' THR . . . . . 0.442 HG23 ' O ' ' A' ' 78' ' ' ASP . 1.7 p -157.17 23.24 0.31 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.182 -0.463 . . . . 60.41 111.12 -179.912 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -68.63 -13.47 62.38 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.259 -0.428 . . . . 72.32 110.863 179.904 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 8.1 t -51.79 -30.04 21.44 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.213 -0.448 . . . . 75.12 110.856 -179.755 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -89.58 -49.82 6.44 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.163 -0.472 . . . . 55.14 110.893 -179.993 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 45.9 tp10 -53.68 -41.91 67.39 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.204 -0.453 . . . . 74.33 110.897 -179.982 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -56.88 -28.27 61.59 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.162 -0.472 . . . . 75.31 110.87 -179.928 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.639 HG21 HG13 ' A' ' 142' ' ' VAL . 62.1 mt -74.88 -47.12 38.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.159 -0.473 . . . . 75.22 111.161 179.955 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 44.8 ttp85 -68.82 -52.25 32.07 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.164 -0.471 . . . . 73.44 110.845 179.977 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.733 ' O ' HG23 ' A' ' 91' ' ' VAL . 16.0 tp10 -54.54 -53.48 53.9 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.24 -0.436 . . . . 74.25 110.908 -179.937 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -53.36 -50.74 64.43 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.127 -0.488 . . . . 74.34 111.12 179.911 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 5.9 t80 -52.12 -51.28 58.84 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.22 -0.445 . . . . 74.33 110.899 -179.957 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 60.0 ttt-85 -59.93 -45.05 93.84 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.199 -0.455 . . . . 65.14 110.873 -179.93 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 91' ' ' VAL . . . . . 0.733 HG23 ' O ' ' A' ' 87' ' ' GLU . 91.6 t -53.94 -45.47 63.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.211 -0.45 . . . . 72.32 111.172 179.954 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 10.7 m-85 -76.39 -26.35 55.49 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.167 -0.47 . . . . 73.54 110.873 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 14.1 t0 -68.11 96.77 0.65 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.159 -0.473 . . . . 72.14 110.889 179.958 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 17.3 mmtt -75.16 -53.2 9.24 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.164 -0.471 . . . . 54.05 110.923 179.973 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 52.9 p30 -77.09 -9.07 58.49 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.215 -0.448 . . . . 73.35 110.808 179.919 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 59.6 26.51 62.42 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.74 -0.743 . . . . 71.5 112.459 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 37.8 p-10 -81.9 -16.12 51.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.878 0.37 . . . . 72.41 110.919 -179.905 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 90.08 18.76 49.21 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.773 -0.727 . . . . 42.41 112.483 179.927 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 15.0 m-85 -140.41 132.38 27.76 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.858 0.361 . . . . 72.13 110.917 -179.779 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 62.2 mt -101.2 135.04 39.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.138 -0.483 . . . . 70.5 111.151 179.902 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 89.5 p -117.1 -177.97 3.33 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.167 -0.469 . . . . 60.43 110.843 -179.881 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 102' ' ' ALA . . . . . 0.738 ' O ' HG11 ' A' ' 121' ' ' VAL . . . -70.32 -35.51 73.69 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.139 -0.482 . . . . 74.3 111.058 179.922 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -71.9 -35.28 69.66 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.246 -0.433 . . . . 43.24 111.104 179.931 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -76.88 -46.64 23.78 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.226 -0.443 . . . . 74.51 110.888 -179.909 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 19.0 tp -52.96 -48.01 67.72 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.175 -0.466 . . . . 72.43 110.893 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 106' ' ' ARG . . . . . 0.706 ' HB2' HG21 ' A' ' 121' ' ' VAL . 59.3 ttp85 -51.99 -40.04 60.31 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.199 -0.455 . . . . 64.42 110.858 179.975 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 13.5 t60 -55.85 -34.4 65.39 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.187 -0.46 . . . . 64.0 110.838 179.994 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 54.5 t -72.59 -52.03 25.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.235 -0.439 . . . . 75.21 111.122 -179.993 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 109' ' ' MET . . . . . 0.479 ' HB3' HD12 ' A' ' 116' ' ' LEU . 10.3 mmt -53.99 -28.12 35.91 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.153 -0.476 . . . . 72.41 110.874 179.908 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 4.0 m -66.9 -37.09 83.73 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.198 -0.455 . . . . 64.12 111.159 -179.907 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 43.0 t-20 -73.48 -26.12 60.76 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.212 -0.449 . . . . 55.4 110.904 179.975 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -70.69 -25.89 63.18 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.165 -0.47 . . . . 72.21 110.934 179.96 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 100.97 19.85 15.89 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.757 -0.735 . . . . 53.22 112.5 179.873 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -111.34 115.68 29.71 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.931 0.396 . . . . 74.0 110.892 -179.896 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 115' ' ' LYS . . . . . 0.584 ' O ' HD23 ' A' ' 116' ' ' LEU . 40.3 pttt -70.65 121.53 18.08 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.123 -0.489 . . . . 71.2 110.935 179.923 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.628 HD22 ' HG2' ' A' ' 120' ' ' GLU . 11.3 mt -143.33 161.0 39.49 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.235 -0.439 . . . . 63.33 110.935 179.947 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 67.9 p -118.59 174.33 6.33 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.205 -0.452 . . . . 63.1 111.089 179.993 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 47.8 m-20 -52.04 -48.35 64.63 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.182 -0.463 . . . . 64.43 110.865 179.9 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -60.67 -33.44 72.83 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.166 -0.47 . . . . 73.32 110.945 -179.929 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 120' ' ' GLU . . . . . 0.628 ' HG2' HD22 ' A' ' 116' ' ' LEU . 1.1 tp10 -68.97 -44.81 72.17 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.133 -0.485 . . . . 71.14 110.904 -179.979 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.738 HG11 ' O ' ' A' ' 102' ' ' ALA . 63.3 t -58.04 -33.32 46.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.174 -0.466 . . . . 71.23 111.106 179.963 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -51.97 -43.76 63.7 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.229 -0.441 . . . . 43.43 110.863 179.934 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 22.9 tp10 -56.33 -31.52 63.8 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.202 -0.454 . . . . 74.43 110.916 -179.928 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 124' ' ' MET . . . . . 0.403 ' HE3' ' HB3' ' M' ' 15' ' ' LYS . 80.0 mtp -76.03 -59.5 2.73 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.16 -0.473 . . . . 74.21 110.891 179.938 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 34.8 mm -53.99 -35.74 29.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.198 -0.455 . . . . 71.35 111.097 179.992 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 9.6 tpt180 -65.43 -31.76 73.02 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.187 -0.46 . . . . 75.13 110.842 179.991 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -71.97 -49.71 35.0 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.202 -0.454 . . . . 53.23 110.852 -179.908 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.563 ' HB3' HG22 ' A' ' 136' ' ' VAL . . . -70.39 -33.66 71.66 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.208 -0.451 . . . . 60.51 111.087 179.936 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 50.7 t0 -68.41 86.63 0.29 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.21 -0.45 . . . . 71.3 110.835 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 59.1 mt -79.98 -45.33 22.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.18 -0.464 . . . . 73.2 111.148 179.962 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 23.1 p30 -72.69 -8.82 57.24 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.168 -0.469 . . . . 61.02 110.833 179.866 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 62.8 43.76 98.47 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.725 -0.75 . . . . 31.33 112.481 -179.925 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 32.5 p-10 -89.33 -16.05 31.99 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.868 0.365 . . . . 64.32 110.882 -179.961 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 102.66 3.37 49.74 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.724 -0.75 . . . . 63.34 112.478 -179.964 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 3.8 tt0 -149.26 172.22 15.23 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.816 0.341 . . . . 74.14 110.923 -179.87 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 136' ' ' VAL . . . . . 0.563 HG22 ' HB3' ' A' ' 128' ' ' ALA . 98.9 t -113.18 114.87 48.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.248 -0.433 . . . . 73.42 111.192 179.94 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 41.9 p-10 -93.28 167.87 11.46 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.174 -0.466 . . . . 74.11 110.928 -179.975 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 138' ' ' TYR . . . . . 0.652 ' O ' HG23 ' A' ' 142' ' ' VAL . 14.1 t80 -51.96 -43.65 63.61 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.218 -0.446 . . . . 72.52 110.971 -179.931 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -55.74 -55.14 35.79 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.148 -0.478 . . . . 52.11 110.881 179.96 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 88.8 mt-10 -62.08 -45.42 93.58 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.172 -0.467 . . . . 65.32 110.9 -179.941 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 69.4 t80 -54.88 -54.94 36.03 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.129 -0.487 . . . . 73.45 110.903 -179.914 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 142' ' ' VAL . . . . . 0.652 HG23 ' O ' ' A' ' 138' ' ' TYR . 96.8 t -53.86 -43.35 56.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.13 -0.486 . . . . 55.41 111.172 179.91 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 5.5 tm0? -64.23 -58.42 6.62 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.155 -0.475 . . . . 71.25 110.934 179.978 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 11.3 tpt -57.5 -24.83 58.17 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.235 -0.439 . . . . 71.22 110.909 179.927 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 145' ' ' MET . . . . . 0.474 ' HE1' HG22 ' M' ' 19' ' ' ILE . 0.3 OUTLIER -86.75 -24.14 25.21 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.2 -0.455 . . . . 73.44 110.898 179.932 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 97.3 m -89.15 -24.85 22.1 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.234 -0.439 . . . . 71.01 111.119 -179.934 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -56.27 156.97 5.2 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.255 -0.43 . . . . 33.14 111.101 179.868 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 116.25 -0.432 . . . . 63.43 110.921 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' M' M ' 8' ' ' LEU . . . . . . . . . . . . . 5.2 mp . . . . . 0 C--O 1.232 0.137 0 CA-C-O 120.768 0.318 . . . . 65.31 110.913 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' M' M ' 9' ' ' SER . . . . . . . . . . . . . 1.3 m -131.73 169.79 15.7 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.243 -0.435 . . . . 75.34 110.901 -179.917 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' M' M ' 10' ' ' GLY . . . . . . . . . . . . . . . -129.2 150.44 18.86 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.719 -0.753 . . . . 53.42 112.454 -179.951 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' M' M ' 11' ' ' GLY . . . . . . . . . . . . . . . 153.81 -64.32 0.35 Allowed Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.777 -0.725 . . . . 72.41 112.52 -179.918 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' M' M ' 12' ' ' GLU . . . . . . . . . . . . . 5.7 pm0 -117.74 161.06 20.31 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.919 0.39 . . . . 74.11 110.847 -179.858 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' M' M ' 13' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -87.4 76.65 9.03 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.126 -0.488 . . . . 71.25 110.89 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' M' M ' 14' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -102.83 24.31 10.84 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.233 -0.44 . . . . 63.41 110.854 179.863 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' M' M ' 15' ' ' LYS . . . . . 0.403 ' HB3' ' HE3' ' A' ' 124' ' ' MET . 7.2 mttp -63.5 -57.25 10.81 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.232 -0.44 . . . . 72.45 110.895 179.986 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' M' M ' 16' ' ' TRP . . . . . . . . . . . . . 67.2 m95 -52.82 -41.46 64.23 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.216 -0.447 . . . . 74.51 110.893 179.909 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' M' M ' 17' ' ' GLU . . . . . . . . . . . . . 15.4 tm-20 -57.4 -30.2 64.74 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.241 -0.436 . . . . 71.53 110.893 -179.929 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' M' M ' 18' ' ' LYS . . . . . . . . . . . . . 15.5 tttp -62.91 -28.03 69.78 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.176 -0.465 . . . . 74.33 110.875 179.946 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' M' M ' 19' ' ' ILE . . . . . 0.474 HG22 ' HE1' ' A' ' 145' ' ' MET . 22.7 mt -98.66 -23.83 4.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.267 -0.424 . . . . 72.13 111.156 179.868 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' M' M ' 20' ' ' ARG . . . . . . . . . . . . . 30.6 ttt-85 -52.04 -30.18 24.48 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.185 -0.461 . . . . 75.41 110.836 -179.971 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' M' M ' 21' ' ' LEU . . . . . . . . . . . . . 4.8 mt 55.03 -175.02 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.216 -0.447 . . . . 52.42 110.889 179.982 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' M' M ' 22' ' ' ARG . . . . . . . . . . . . . 47.3 ttt180 -125.29 136.78 28.66 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.583 0.706 . . . . 73.22 110.861 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' M' M ' 23' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.78 128.44 16.01 Favored 'Trans proline' 0 C--N 1.341 0.157 0 C-N-CA 122.679 2.252 . . . . 75.55 112.346 179.957 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' M' M ' 24' ' ' GLY . . . . . . . . . . . . . . . -178.19 48.58 0.1 OUTLIER Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.727 -0.749 . . . . 53.01 112.458 179.973 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' M' M ' 25' ' ' GLY . . . . . . . . . . . . . . . -127.85 -133.48 3.75 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.768 -0.73 . . . . 51.3 112.525 -179.979 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' M' M ' 26' ' ' LYS . . . . . . . . . . . . . 22.6 ttpp -178.61 118.7 0.08 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.801 0.334 . . . . 63.21 110.879 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' M' M ' 27' ' ' LYS . . . . . . . . . . . . . 3.0 mmmp? -150.7 -76.54 0.14 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.242 -0.435 . . . . 72.44 110.867 179.839 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' M' M ' 28' ' ' GLN . . . . . . . . . . . . . 4.2 pt20 179.04 167.79 0.96 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.247 -0.433 . . . . 75.43 110.883 179.94 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' M' M ' 29' ' ' TYR . . . . . 0.493 ' CE2' HG12 ' A' ' 55' ' ' VAL . 3.5 m-85 -66.8 176.9 1.82 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.157 -0.474 . . . . 71.23 110.905 -179.831 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' M' M ' 30' ' ' LYS . . . . . . . . . . . . . 2.1 pttp -107.37 15.85 24.52 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.117 -0.492 . . . . 75.03 110.857 179.938 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' M' M ' 31' ' ' LEU . . . . . 0.593 ' HA ' HD12 ' M' ' 34' ' ' ILE . 7.2 tp -124.33 -48.78 1.82 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.228 -0.442 . . . . 71.25 110.918 179.935 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' M' M ' 32' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -47.21 -40.15 15.62 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.212 -0.449 . . . . 71.21 110.937 179.809 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' M' M ' 33' ' ' HIS . . . . . . . . . . . . . 79.9 t60 -48.12 -46.35 34.04 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.148 -0.478 . . . . 74.21 110.865 179.913 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' M' M ' 34' ' ' ILE . . . . . 0.593 HD12 ' HA ' ' M' ' 31' ' ' LEU . 3.3 mt -51.77 -38.57 22.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.214 -0.448 . . . . 72.24 111.096 179.996 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' M' M ' 35' ' ' VAL . . . . . 0.414 HG11 ' HE3' ' A' ' 72' ' ' MET . 48.5 t -50.1 -38.9 15.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.18 -0.464 . . . . 45.35 111.107 179.886 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' M' M ' 36' ' ' TRP . . . . . . . . . . . . . 26.6 m0 -59.29 -39.03 81.67 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.188 -0.46 . . . . 73.21 110.914 179.954 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' M' M ' 37' ' ' ALA . . . . . 0.891 ' HB3' HD13 ' A' ' 39' ' ' LEU . . . -63.94 -18.39 64.2 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.225 -0.443 . . . . 70.14 111.095 179.911 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' M' M ' 38' ' ' SER . . . . . 0.477 ' HB3' HD23 ' A' ' 18' ' ' LEU . 2.5 m -71.07 -17.94 62.58 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.243 -0.435 . . . . 50.34 110.857 -179.803 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' M' M ' 39' ' ' ARG . . . . . . . . . . . . . 14.9 mmm180 -52.07 -29.96 23.71 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.151 -0.477 . . . . 73.41 110.849 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' M' M ' 40' ' ' GLU . . . . . . . . . . . . . 9.4 tt0 -92.37 -40.71 10.74 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.21 -0.45 . . . . 64.44 110.915 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' M' M ' 41' ' ' LEU . . . . . 0.419 HD21 ' OG ' ' A' ' 38' ' ' SER . 5.0 mt -52.31 170.13 0.07 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.162 -0.472 . . . . 62.13 110.931 179.991 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' M' M ' 42' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -124.64 -50.21 1.74 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.176 -0.466 . . . . 61.23 110.883 179.944 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' M' M ' 43' ' ' ARG . . . . . . . . . . . . . 10.3 mmt85 . . . . . 0 C--N 1.329 -0.286 0 CA-C-N 116.158 -0.474 . . . . 60.44 110.872 -179.891 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 241' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 262' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 301' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 322' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.158 0 CA-C-O 120.775 0.321 . . . . 64.24 111.116 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -100.94 34.56 2.45 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.227 -0.442 . . . . 74.22 110.856 179.982 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 48.7 mt-30 -144.64 100.89 3.59 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.183 -0.462 . . . . 70.11 110.901 -179.913 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.77 HD22 ' HG2' ' A' ' 8' ' ' GLN . 68.3 mt -96.12 149.13 21.96 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.16 -0.473 . . . . 71.34 110.878 -179.928 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 7.5 p -120.67 174.48 6.55 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.211 -0.449 . . . . 42.43 111.13 179.936 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -52.92 -30.0 31.82 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.236 -0.438 . . . . 74.11 110.875 -180.0 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -65.9 -41.88 90.95 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.167 -0.47 . . . . 75.41 110.836 -179.89 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' GLN . . . . . 0.77 ' HG2' HD22 ' A' ' 4' ' ' LEU . 1.6 tp-100 -77.92 -41.46 36.34 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.163 -0.471 . . . . 72.14 110.904 -179.924 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 62.0 mt -67.04 -37.14 78.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.212 -0.449 . . . . 55.1 111.124 179.976 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -51.95 -49.9 62.27 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.191 -0.459 . . . . 63.54 111.098 179.815 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 25.3 mm-40 -54.87 -52.24 63.45 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.179 -0.464 . . . . 74.42 110.931 -179.966 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 66.0 m-85 -60.04 -44.17 94.83 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.123 -0.489 . . . . 73.43 110.933 -179.953 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 38.0 ttmt -51.98 -33.5 38.26 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.088 -0.505 . . . . 63.1 110.866 -179.996 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -68.74 -36.65 78.66 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.234 -0.439 . . . . 71.11 110.904 179.975 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -66.52 -52.28 47.52 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.14 -0.482 . . . . 40.02 111.076 179.931 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 42.4 t80 -52.6 -47.44 66.94 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.19 -0.459 . . . . 63.44 110.859 -179.898 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.6 m -59.48 -28.98 67.5 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.156 -0.475 . . . . 53.51 110.885 -179.793 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.65 HD23 ' HB3' ' M' ' 38' ' ' SER . 15.3 tp -68.59 -47.54 66.48 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.111 -0.495 . . . . 75.4 110.897 -179.995 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 62.1 m-85 -71.67 -26.09 62.39 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.178 -0.465 . . . . 61.02 110.89 179.928 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 18.6 t0 -86.33 98.47 10.99 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.154 -0.475 . . . . 71.42 110.845 -179.996 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 39.6 mtpt -71.86 -53.12 14.21 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.216 -0.447 . . . . 74.21 110.862 -179.977 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 26.3 p-10 -73.5 -10.11 59.39 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.244 -0.435 . . . . 73.44 110.802 179.912 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 52.03 46.45 55.88 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.792 -0.718 . . . . 52.45 112.451 -179.946 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 26.7 p-10 -88.46 -15.73 34.62 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.891 0.377 . . . . 71.5 110.906 179.993 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 105.32 -11.73 47.65 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.696 -0.764 . . . . 65.03 112.508 -179.902 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 51.6 p -131.31 130.71 43.09 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.755 0.312 . . . . 72.23 111.157 -179.886 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 29.8 mt -90.72 135.82 25.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.206 -0.452 . . . . 65.34 111.138 179.898 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.672 HG22 HG22 ' A' ' 62' ' ' THR . 15.0 p -115.97 -179.37 3.64 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.195 -0.457 . . . . 61.04 111.176 179.936 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.685 HG23 HD12 ' A' ' 52' ' ' ILE . 8.2 p -68.69 -33.02 73.25 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.227 -0.442 . . . . 73.25 111.167 -179.988 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 14.8 ptpt -69.6 -41.42 75.75 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.194 -0.457 . . . . 75.32 110.889 179.878 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.491 ' O ' HG23 ' A' ' 35' ' ' VAL . 62.1 mt-10 -75.9 -35.4 59.83 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.22 -0.445 . . . . 75.34 110.924 179.968 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.1 tt -74.31 -53.78 9.01 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.136 -0.484 . . . . 75.55 110.904 -179.962 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -52.1 -43.28 56.08 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.801 -0.714 . . . . 65.41 112.488 179.904 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 96.0 m -56.97 -55.07 39.45 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.816 0.341 . . . . 75.3 111.146 -179.896 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.491 HG23 ' O ' ' A' ' 31' ' ' GLU . 100.0 t -51.67 -50.22 31.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.21 -0.45 . . . . 65.13 111.096 179.937 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 7.5 mtp -51.97 -39.07 58.77 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.16 -0.473 . . . . 61.31 110.905 179.932 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 30.1 ttt85 -54.11 -40.15 67.04 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.179 -0.464 . . . . 63.5 110.837 -179.9 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' SER . . . . . 0.611 ' OG ' HD21 ' M' ' 41' ' ' LEU . 3.8 t -76.8 -28.39 55.59 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.179 -0.464 . . . . 60.43 110.904 -179.809 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 1.009 HD13 ' HB3' ' M' ' 37' ' ' ALA . 58.6 mt -76.98 -21.49 54.63 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.127 -0.488 . . . . 72.51 110.909 179.986 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 101.45 31.11 5.65 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.753 -0.737 . . . . 73.32 112.476 179.858 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 2.2 tp-100 -116.96 140.32 49.61 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.842 0.353 . . . . 75.21 110.856 -179.85 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 29.8 t30 -109.87 76.8 0.99 Allowed Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.63 0.729 . . . . 72.12 110.913 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.75 140.0 41.64 Favored 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.71 2.274 . . . . 60.02 112.311 179.951 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 19.9 p -97.29 158.35 15.5 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.2 -0.454 . . . . 74.54 111.157 -179.986 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -51.94 -43.41 63.46 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.225 -0.443 . . . . 75.42 110.914 179.966 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.36 -32.93 64.81 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.18 -0.463 . . . . 65.32 111.088 179.937 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 11.0 tt0 -67.57 -50.77 56.85 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.194 -0.457 . . . . 55.44 110.89 -179.936 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.66 ' HB3' HG22 ' A' ' 29' ' ' THR . 45.9 mt -55.05 -51.85 65.02 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.172 -0.467 . . . . 70.2 110.951 179.984 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 29.8 tp60 -57.24 -29.07 63.47 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.148 -0.478 . . . . 65.33 110.94 179.89 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -72.17 -37.6 69.3 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.208 -0.451 . . . . 72.1 110.881 179.964 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' MET . . . . . 0.49 ' O ' HG22 ' A' ' 55' ' ' VAL . 5.7 mtp -63.7 -57.89 8.59 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.172 -0.467 . . . . 73.33 110.858 179.985 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.685 HD12 HG23 ' A' ' 29' ' ' THR . 62.4 mt -54.89 -45.27 75.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.243 -0.435 . . . . 74.41 111.143 179.972 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 76.8 m-20 -66.32 -33.84 76.63 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.183 -0.462 . . . . 71.33 110.884 179.921 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -63.12 -30.56 71.68 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.212 -0.449 . . . . 75.01 110.861 -179.965 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.49 HG22 ' O ' ' A' ' 51' ' ' MET . 4.8 m -111.12 18.98 7.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.162 -0.472 . . . . 73.15 111.095 -179.987 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 31.5 t0 -89.99 93.06 9.25 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.205 -0.452 . . . . 63.11 110.889 179.893 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.16 -33.71 18.1 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.249 -0.432 . . . . 71.15 111.079 179.962 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 14.7 p30 -91.35 -0.15 57.61 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.226 -0.443 . . . . 35.52 110.868 179.962 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 52.35 59.54 8.86 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.726 -0.75 . . . . 70.41 112.496 -179.899 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 51.5 p-10 -114.48 -15.73 12.01 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.833 0.349 . . . . 70.23 110.919 -179.926 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 89.77 18.46 51.32 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.715 -0.755 . . . . 72.23 112.505 179.966 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' THR . . . . . 0.672 HG22 HG22 ' A' ' 28' ' ' THR . 22.5 p -152.65 159.37 43.2 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.788 0.328 . . . . 54.32 111.167 -179.914 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.465 HG21 ' HD1' ' A' ' 68' ' ' PHE . 25.1 mt -91.94 109.48 21.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.215 -0.448 . . . . 75.4 111.137 179.907 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.4 t0 -73.82 -176.42 2.43 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.152 -0.476 . . . . 70.51 110.867 179.875 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.534 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 2.5 t80 -62.85 -58.32 17.19 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-O 121.652 0.739 . . . . 72.3 110.914 -179.887 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 66' ' ' PRO . . . . . 0.534 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 53.7 Cg_endo -69.81 -30.02 22.7 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.697 2.264 . . . . 52.13 112.344 179.982 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 -57.24 -41.47 79.6 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.205 -0.452 . . . . 72.13 110.918 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' PHE . . . . . 0.465 ' HD1' HG21 ' A' ' 63' ' ' ILE . 24.2 t80 -74.14 -36.1 64.12 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.106 -0.497 . . . . 75.4 110.886 -179.971 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 28.9 tp -65.48 -53.65 39.5 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.155 -0.475 . . . . 72.14 110.887 -179.937 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 11.2 t -54.02 -26.69 27.61 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.247 -0.433 . . . . 74.44 111.129 179.967 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' MET . . . . . 0.411 ' SD ' HD23 ' M' ' 31' ' ' LEU . 42.9 ttp -70.67 -35.46 72.85 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.208 -0.451 . . . . 73.43 110.89 179.937 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 11.1 mtp -77.69 -33.72 53.14 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.213 -0.449 . . . . 73.24 110.888 179.938 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -74.84 -46.05 39.08 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.227 -0.442 . . . . 54.31 111.059 179.958 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 22.8 ttm180 -52.53 -34.8 51.6 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.238 -0.437 . . . . 75.53 110.926 -179.909 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -81.34 -27.09 35.1 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.15 -0.477 . . . . 74.35 110.835 179.978 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 11.0 tpt -60.7 -26.15 66.93 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.242 -0.435 . . . . 73.2 110.868 179.886 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 20.0 tptp -151.04 89.66 1.54 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.234 -0.439 . . . . 73.33 110.907 179.939 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -106.71 179.82 4.16 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.261 -0.427 . . . . 73.43 110.863 179.837 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 1.8 m -104.43 25.24 10.44 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.144 -0.48 . . . . 72.02 111.13 -179.927 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -86.66 -33.49 20.08 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.231 -0.44 . . . . 72.34 110.885 179.859 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 4.5 t -52.38 -37.05 55.41 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.197 -0.456 . . . . 71.03 110.868 -179.762 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.755 ' HA ' HD12 ' A' ' 85' ' ' ILE . 4.9 tm-20 -52.31 -29.86 25.53 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.1 -0.5 . . . . 61.2 110.91 -179.933 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 6.6 tt0 -63.88 -40.71 97.16 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.163 -0.472 . . . . 75.32 110.836 -179.906 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 11.1 tp10 -77.89 -38.47 45.69 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.15 -0.477 . . . . 65.43 110.898 -179.914 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.755 HD12 ' HA ' ' A' ' 82' ' ' GLU . 54.8 mt -55.48 -51.0 62.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.131 -0.486 . . . . 71.42 111.133 179.988 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.16 -30.3 26.15 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.104 -0.498 . . . . 73.11 110.882 179.988 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.411 ' O ' HG23 ' A' ' 91' ' ' VAL . 11.1 tt0 -76.41 -56.95 4.16 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.211 -0.449 . . . . 74.3 110.866 -179.953 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 88' ' ' ALA . . . . . 0.503 ' HB1' ' CE2' ' A' ' 92' ' ' PHE . . . -54.82 -43.23 72.78 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.141 -0.482 . . . . 73.5 111.089 179.962 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 8.8 t80 -52.02 -51.19 59.01 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.226 -0.443 . . . . 75.21 110.892 -179.953 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 50.3 ttt-85 -58.84 -44.89 91.07 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.124 -0.489 . . . . 73.24 110.902 -179.939 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 91' ' ' VAL . . . . . 0.411 HG23 ' O ' ' A' ' 87' ' ' GLU . 57.6 t -54.67 -49.36 68.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.178 -0.465 . . . . 63.24 111.185 179.938 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.503 ' CE2' ' HB1' ' A' ' 88' ' ' ALA . 8.9 m-85 -70.92 -32.36 69.26 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.149 -0.478 . . . . 72.15 110.889 179.986 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 16.6 t0 -61.71 96.72 0.07 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.175 -0.466 . . . . 75.21 110.822 179.983 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 58.2 mmtt -76.24 -53.17 8.64 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.175 -0.466 . . . . 60.02 110.876 179.993 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 56.0 p-10 -76.02 -9.17 58.4 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.216 -0.447 . . . . 72.44 110.872 179.868 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 59.64 26.87 63.03 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.733 -0.746 . . . . 24.43 112.45 -179.96 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 42.4 p-10 -81.77 -16.17 51.87 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.863 0.363 . . . . 75.1 110.908 -179.956 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 91.89 18.75 42.63 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.748 -0.739 . . . . 73.21 112.494 -179.998 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 6.2 m-85 -136.42 159.32 42.12 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.855 0.36 . . . . 72.02 110.907 -179.802 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 62.8 mt -122.4 123.95 69.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.143 -0.48 . . . . 65.41 111.127 179.93 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 63.2 p -107.17 -172.58 2.11 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.175 -0.466 . . . . 54.12 110.835 -179.913 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 102' ' ' ALA . . . . . 0.675 ' O ' HG11 ' A' ' 121' ' ' VAL . . . -73.96 -36.6 64.6 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.112 -0.494 . . . . 55.03 111.056 179.935 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -72.0 -31.37 66.16 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.228 -0.442 . . . . 73.51 111.11 179.983 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -74.9 -48.69 23.39 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.163 -0.471 . . . . 71.53 110.882 -179.924 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 22.1 tp -54.02 -47.89 71.05 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.162 -0.472 . . . . 74.22 110.937 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 106' ' ' ARG . . . . . 0.56 ' O ' HG23 ' A' ' 110' ' ' THR . 42.2 ttp85 -52.37 -44.53 65.33 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.182 -0.463 . . . . 71.45 110.904 179.911 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 11.1 t60 -58.45 -34.53 70.94 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.202 -0.453 . . . . 74.03 110.832 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 92.7 t -67.04 -52.2 46.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.201 -0.454 . . . . 71.21 111.175 179.948 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 109' ' ' MET . . . . . 0.421 ' HA ' HD12 ' A' ' 112' ' ' LEU . 4.2 mmt -64.2 -46.07 85.5 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.139 -0.482 . . . . 61.33 110.85 179.905 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 110' ' ' THR . . . . . 0.56 HG23 ' O ' ' A' ' 106' ' ' ARG . 41.8 p -51.88 -37.16 51.18 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.24 -0.436 . . . . 61.32 111.174 -179.933 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 43.8 t30 -57.86 -33.7 68.96 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.211 -0.45 . . . . 72.34 110.916 179.953 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.699 HD13 ' HE3' ' M' ' 18' ' ' LYS . 15.3 mt -70.7 -23.9 62.55 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.151 -0.477 . . . . 72.4 110.908 179.943 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 101.06 32.93 5.13 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.714 -0.755 . . . . 74.32 112.428 179.883 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -110.07 116.27 31.26 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.92 0.391 . . . . 74.24 110.898 -179.918 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 29.3 tttm -60.73 120.29 9.79 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.153 -0.476 . . . . 73.31 110.931 179.96 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.452 HD22 ' HG2' ' A' ' 120' ' ' GLU . 19.8 mt -145.88 155.42 42.87 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.246 -0.434 . . . . 71.04 110.897 179.92 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 41.0 p -118.73 169.03 10.18 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.168 -0.469 . . . . 72.42 111.177 179.943 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 41.2 m-20 -53.07 -46.08 68.43 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.268 -0.424 . . . . 72.42 110.897 179.887 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 17.9 tt0 -63.54 -34.23 77.35 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.188 -0.46 . . . . 71.33 110.867 -179.921 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 120' ' ' GLU . . . . . 0.452 ' HG2' HD22 ' A' ' 116' ' ' LEU . 2.3 tp10 -67.23 -32.65 73.84 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.186 -0.461 . . . . 64.33 110.871 -179.902 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.675 HG11 ' O ' ' A' ' 102' ' ' ALA . 92.8 t -69.48 -32.67 53.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.154 -0.475 . . . . 62.31 111.137 179.971 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 10.8 t0 -51.95 -46.92 64.92 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.18 -0.464 . . . . 63.32 110.878 179.948 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -55.74 -29.3 59.32 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.131 -0.486 . . . . 72.5 110.873 -179.898 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 1.2 mtp -75.37 -59.74 2.61 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.155 -0.475 . . . . 65.21 110.866 -179.997 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 35.5 mm -54.13 -35.61 29.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.215 -0.448 . . . . 71.33 111.11 179.977 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 51.2 ttt180 -63.03 -31.78 72.99 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.174 -0.466 . . . . 74.51 110.893 179.957 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 9.7 tt0 -75.33 -52.48 10.71 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.183 -0.462 . . . . 71.32 110.883 -179.893 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.528 ' HB3' ' CG2' ' A' ' 136' ' ' VAL . . . -64.92 -33.87 77.07 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.117 -0.492 . . . . 52.44 111.071 179.959 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 49.5 t0 -68.73 86.31 0.32 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.238 -0.437 . . . . 73.33 110.882 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 130' ' ' ILE . . . . . 0.694 HD12 ' HG2' ' A' ' 140' ' ' GLU . 4.0 mt -79.91 -45.72 22.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.229 -0.442 . . . . 75.02 111.128 -179.952 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 22.0 p30 -72.77 -8.8 57.18 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.184 -0.462 . . . . 73.41 110.88 179.823 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 62.86 44.41 97.48 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.73 -0.748 . . . . 55.54 112.518 -179.891 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 31.8 p-10 -90.44 -15.95 29.92 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.841 0.353 . . . . 75.24 110.882 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 101.97 3.77 51.62 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.726 -0.75 . . . . 75.21 112.518 -179.906 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 4.4 tt0 -149.29 172.31 15.09 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.873 0.368 . . . . 75.41 110.91 -179.857 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 136' ' ' VAL . . . . . 0.528 ' CG2' ' HB3' ' A' ' 128' ' ' ALA . 66.9 t -114.78 111.09 34.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.187 -0.461 . . . . 53.15 111.166 179.964 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 45.4 p-10 -93.67 171.66 8.75 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.17 -0.468 . . . . 70.4 110.915 -179.986 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 138' ' ' TYR . . . . . 0.701 ' O ' HG23 ' A' ' 142' ' ' VAL . 86.9 t80 -56.18 -46.83 79.21 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.232 -0.44 . . . . 72.42 110.901 -179.901 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 22.1 tt0 -52.11 -44.56 64.51 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.097 -0.501 . . . . 63.03 110.914 -179.981 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 140' ' ' GLU . . . . . 0.694 ' HG2' HD12 ' A' ' 130' ' ' ILE . 94.9 mt-10 -73.94 -40.26 63.2 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.166 -0.47 . . . . 62.51 110.87 -179.929 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 141' ' ' PHE . . . . . 0.562 ' HE1' HG23 ' A' ' 85' ' ' ILE . 42.7 t80 -60.47 -41.34 93.97 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.176 -0.465 . . . . 72.01 110.884 -179.936 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 142' ' ' VAL . . . . . 0.701 HG23 ' O ' ' A' ' 138' ' ' TYR . 99.7 t -60.19 -49.46 84.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.165 -0.47 . . . . 72.24 111.162 179.963 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 143' ' ' GLN . . . . . 0.548 ' HA ' HG22 ' A' ' 146' ' ' THR . 29.7 tt0 -72.28 -23.47 61.19 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.191 -0.459 . . . . 75.2 110.911 179.994 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 10.8 tpt -74.99 -18.79 60.31 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.241 -0.436 . . . . 72.31 110.872 179.958 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 9.2 ttm -98.22 -32.93 11.31 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.214 -0.448 . . . . 74.1 110.894 179.94 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 146' ' ' THR . . . . . 0.548 HG22 ' HA ' ' A' ' 143' ' ' GLN . 5.0 t -73.35 -24.15 60.31 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.243 -0.435 . . . . 43.15 111.11 -179.91 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -65.94 141.72 58.12 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.216 -0.447 . . . . 73.04 111.096 179.838 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.3 0 CA-C-N 116.192 -0.458 . . . . 72.53 110.904 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' M' M ' 8' ' ' LEU . . . . . . . . . . . . . 6.9 tp . . . . . 0 C--O 1.231 0.089 0 CA-C-O 120.836 0.35 . . . . 75.23 110.945 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' M' M ' 9' ' ' SER . . . . . . . . . . . . . 6.9 t 55.97 -176.91 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.17 -0.468 . . . . 65.22 110.875 -179.895 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' M' M ' 10' ' ' GLY . . . . . . . . . . . . . . . -138.19 -79.48 0.08 OUTLIER Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.755 -0.736 . . . . 74.31 112.468 -179.953 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' M' M ' 11' ' ' GLY . . . . . . . . . . . . . . . 83.3 -54.31 4.95 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.754 -0.736 . . . . 72.35 112.527 -179.891 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' M' M ' 12' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -82.74 128.13 34.08 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.908 0.385 . . . . 72.41 110.853 -179.877 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' M' M ' 13' ' ' LEU . . . . . . . . . . . . . 15.0 tp -51.72 122.81 8.79 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.186 -0.461 . . . . 65.05 110.909 -179.999 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' M' M ' 14' ' ' ASP . . . . . . . . . . . . . 35.0 t0 -107.63 73.64 0.92 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.169 -0.469 . . . . 70.51 110.864 179.854 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' M' M ' 15' ' ' LYS . . . . . . . . . . . . . 3.0 mttp -62.65 -17.07 59.73 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.179 -0.464 . . . . 54.34 110.901 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' M' M ' 16' ' ' TRP . . . . . . . . . . . . . 73.9 m95 -50.85 -32.74 21.26 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.199 -0.455 . . . . 71.23 110.929 179.918 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' M' M ' 17' ' ' GLU . . . . . . . . . . . . . 59.1 tt0 -54.08 -34.54 60.41 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.218 -0.447 . . . . 73.32 110.914 179.998 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' M' M ' 18' ' ' LYS . . . . . 0.699 ' HE3' HD13 ' A' ' 112' ' ' LEU . 23.4 tttp -65.16 -28.55 69.48 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.152 -0.476 . . . . 71.42 110.908 179.953 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' M' M ' 19' ' ' ILE . . . . . . . . . . . . . 28.6 mt -90.7 -29.98 4.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.214 -0.448 . . . . 64.22 111.157 179.879 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' M' M ' 20' ' ' ARG . . . . . . . . . . . . . 39.0 ttp85 -54.32 -28.05 39.89 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.147 -0.479 . . . . 75.43 110.87 179.928 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' M' M ' 21' ' ' LEU . . . . . . . . . . . . . 5.0 mt 57.64 -175.13 0.07 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.182 -0.463 . . . . 73.45 110.914 -179.959 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' M' M ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -108.96 144.14 29.03 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.614 0.721 . . . . 73.3 110.829 179.97 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' M' M ' 23' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.81 -48.29 0.74 Allowed 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.652 2.235 . . . . 75.31 112.326 179.987 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' M' M ' 24' ' ' GLY . . . . . . . . . . . . . . . 87.56 -74.5 2.23 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.694 -0.765 . . . . 73.42 112.466 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' M' M ' 25' ' ' GLY . . . . . . . . . . . . . . . 156.45 -107.56 0.33 Allowed Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.77 -0.729 . . . . 62.54 112.515 -179.91 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' M' M ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 39.4 41.6 0.72 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.871 0.367 . . . . 74.3 110.911 -179.976 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' M' M ' 27' ' ' LYS . . . . . . . . . . . . . 11.7 mmmt -92.54 172.88 8.09 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.26 -0.427 . . . . 75.44 110.912 179.875 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' M' M ' 28' ' ' GLN . . . . . . . . . . . . . 36.0 mm-40 -55.29 -70.03 0.12 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.263 -0.426 . . . . 61.12 110.918 179.946 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' M' M ' 29' ' ' TYR . . . . . . . . . . . . . 5.0 m-85 -52.15 123.77 11.42 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.194 -0.457 . . . . 62.0 110.935 -179.869 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' M' M ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.02 34.91 4.58 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.133 -0.485 . . . . 53.42 110.891 179.913 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' M' M ' 31' ' ' LEU . . . . . 0.896 HD12 HD12 ' M' ' 34' ' ' ILE . 14.8 tp -124.39 -41.44 2.17 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.262 -0.426 . . . . 70.42 110.926 179.935 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' M' M ' 32' ' ' LYS . . . . . . . . . . . . . 42.6 tttt -49.57 -42.87 45.49 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.178 -0.465 . . . . 53.14 110.909 179.827 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' M' M ' 33' ' ' HIS . . . . . . . . . . . . . 80.7 t60 -50.33 -39.19 45.27 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.185 -0.461 . . . . 73.54 110.851 179.912 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' M' M ' 34' ' ' ILE . . . . . 0.896 HD12 HD12 ' M' ' 31' ' ' LEU . 62.3 mt -50.7 -39.46 18.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.204 -0.453 . . . . 70.22 111.138 179.987 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' M' M ' 35' ' ' VAL . . . . . . . . . . . . . 98.9 t -49.8 -39.22 14.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.129 -0.487 . . . . 74.32 111.158 179.863 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' M' M ' 36' ' ' TRP . . . . . . . . . . . . . 29.9 m0 -58.85 -39.16 80.48 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.139 -0.482 . . . . 73.54 110.933 179.965 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' M' M ' 37' ' ' ALA . . . . . 1.009 ' HB3' HD13 ' A' ' 39' ' ' LEU . . . -63.9 -18.59 64.36 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.216 -0.447 . . . . 62.34 111.117 179.88 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' M' M ' 38' ' ' SER . . . . . 0.65 ' HB3' HD23 ' A' ' 18' ' ' LEU . 0.7 OUTLIER -73.94 -17.9 60.96 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.185 -0.461 . . . . 30.33 110.848 -179.742 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' M' M ' 39' ' ' ARG . . . . . . . . . . . . . 50.7 mtp180 -55.55 -31.4 62.11 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.131 -0.486 . . . . 72.13 110.85 -179.944 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' M' M ' 40' ' ' GLU . . . . . . . . . . . . . 14.3 tp10 -79.94 -46.53 16.55 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.156 -0.474 . . . . 73.52 110.89 -179.934 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' M' M ' 41' ' ' LEU . . . . . 0.611 HD21 ' OG ' ' A' ' 38' ' ' SER . 11.9 mt -61.4 116.09 4.39 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.14 -0.482 . . . . 72.41 110.89 -179.936 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' M' M ' 42' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -53.94 160.82 1.35 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.158 -0.474 . . . . 70.4 110.9 179.923 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' M' M ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.342 0 CA-C-N 116.169 -0.469 . . . . 73.33 110.906 -179.923 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 241' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 262' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 301' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 322' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.139 0 CA-C-O 120.794 0.331 . . . . 61.0 111.083 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -72.57 79.04 1.07 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.236 -0.438 . . . . 44.22 110.869 179.968 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 4.6 tt0 -105.93 36.44 2.56 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.2 -0.454 . . . . 74.34 110.948 -179.945 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.528 HD13 ' HG2' ' A' ' 8' ' ' GLN . 4.0 mm? -102.25 109.46 21.14 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.148 -0.478 . . . . 64.52 110.88 -179.986 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 5.5 p -100.38 176.71 5.27 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.185 -0.461 . . . . 51.15 111.119 179.937 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 20.6 tt0 -58.04 -36.23 72.45 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.217 -0.447 . . . . 74.43 110.919 -179.982 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 65.3 tt0 -67.66 -35.81 79.56 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.131 -0.486 . . . . 72.43 110.88 -179.949 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' GLN . . . . . 0.528 ' HG2' HD13 ' A' ' 4' ' ' LEU . 8.5 tp-100 -77.98 -41.43 36.06 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.199 -0.455 . . . . 72.11 110.942 -179.964 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 59.2 mt -70.5 -43.33 78.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.238 -0.437 . . . . 65.24 111.116 179.932 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -52.11 -29.62 22.54 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.21 -0.45 . . . . 55.55 111.078 179.847 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 43.7 mm-40 -74.66 -52.0 12.84 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.28 -0.418 . . . . 73.13 110.882 -179.952 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 24.2 m-85 -61.91 -46.04 91.08 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.153 -0.476 . . . . 75.31 110.845 -179.88 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 34.1 ttmt -55.33 -26.98 44.07 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.117 -0.492 . . . . 72.23 110.95 179.962 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 56.4 tt0 -72.61 -38.72 67.72 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.222 -0.445 . . . . 74.42 110.888 179.927 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -63.77 -43.4 96.5 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.181 -0.463 . . . . 73.5 111.103 179.942 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 67.1 t80 -57.12 -53.7 55.06 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.197 -0.456 . . . . 63.14 110.904 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 46.9 m -52.35 -34.24 46.53 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.133 -0.485 . . . . 74.13 110.871 -179.795 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.64 HD23 ' HB3' ' M' ' 38' ' ' SER . 16.6 tp -62.43 -46.68 87.46 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.09 -0.505 . . . . 70.23 110.913 179.996 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.491 ' CE1' HG11 ' A' ' 35' ' ' VAL . 46.2 m-85 -71.95 -25.98 62.1 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.2 -0.454 . . . . 44.31 110.877 179.933 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 13.9 t0 -82.69 98.54 9.11 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.138 -0.483 . . . . 72.31 110.852 179.995 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 15.8 ttmm -67.88 -51.76 44.37 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.168 -0.469 . . . . 63.04 110.863 -179.989 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 29.9 p-10 -79.57 -10.1 59.74 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.217 -0.447 . . . . 63.35 110.884 179.925 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 51.96 44.32 55.99 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.764 -0.732 . . . . 51.4 112.454 -179.938 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 17.2 p-10 -88.5 -15.72 34.55 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.813 0.339 . . . . 74.14 110.851 -179.989 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 102.24 17.09 21.19 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.716 -0.754 . . . . 64.11 112.521 -179.919 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -154.58 131.43 10.81 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.76 0.315 . . . . 51.41 111.133 -179.85 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.436 HG21 HD23 ' A' ' 32' ' ' LEU . 23.3 mt -92.51 111.67 24.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.256 -0.429 . . . . 64.25 111.128 179.941 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.698 HG22 HG21 ' A' ' 62' ' ' THR . 19.6 p -97.78 178.21 5.22 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.2 -0.454 . . . . 72.32 111.093 -179.989 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 3.0 p -62.77 -27.19 69.12 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.205 -0.452 . . . . 73.24 111.184 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 7.8 mmmm -69.78 -50.09 46.56 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.173 -0.467 . . . . 42.1 110.899 179.93 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.42 ' O ' HG23 ' A' ' 35' ' ' VAL . 33.6 mt-10 -74.24 -32.71 63.08 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.214 -0.448 . . . . 74.12 110.899 179.95 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.576 HD13 ' O ' ' A' ' 32' ' ' LEU . 1.0 OUTLIER -74.14 -41.26 61.82 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.145 -0.479 . . . . 75.51 110.912 179.996 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -70.67 -34.43 66.93 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.801 -0.714 . . . . 74.24 112.5 179.887 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 96.7 m -67.43 -59.88 3.02 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.784 0.326 . . . . 70.3 111.136 -179.809 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.491 HG11 ' CE1' ' A' ' 19' ' ' PHE . 66.7 t -52.94 -52.11 31.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.194 -0.457 . . . . 72.33 111.132 179.903 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 6.3 ttt -51.93 -29.97 22.5 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.179 -0.464 . . . . 74.41 110.902 179.899 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 3.7 tmm_? -72.65 -52.85 13.64 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.17 -0.468 . . . . 71.11 110.884 -179.971 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 4.6 t -58.52 -25.69 62.69 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.23 -0.441 . . . . 74.33 110.907 -179.811 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.98 HD13 ' HB3' ' M' ' 37' ' ' ALA . 61.2 mt -78.15 -13.88 59.69 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.101 -0.5 . . . . 64.34 110.936 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 101.5 23.88 9.19 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.778 -0.725 . . . . 52.35 112.518 179.936 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 8.3 tp-100 -124.59 129.35 50.4 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.785 0.326 . . . . 72.53 110.931 -179.904 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 61.1 t30 -109.71 82.46 2.31 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.591 0.71 . . . . 71.13 110.902 -179.957 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.8 167.97 22.95 Favored 'Trans proline' 0 C--O 1.232 0.221 0 C-N-CA 122.72 2.28 . . . . 52.43 112.324 179.988 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 20.5 p -112.53 155.47 24.27 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.249 -0.432 . . . . 61.33 111.195 -179.993 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -51.91 -40.51 60.84 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.227 -0.442 . . . . 52.13 110.886 179.984 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.44 -31.46 63.83 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.145 -0.48 . . . . 73.05 111.112 179.973 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -70.76 -49.71 43.82 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.217 -0.447 . . . . 73.33 110.873 -179.933 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.522 ' CD2' HD12 ' A' ' 32' ' ' LEU . 13.9 mt -55.07 -51.0 67.73 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.175 -0.466 . . . . 72.25 110.926 -179.986 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 15.4 tp60 -59.93 -28.39 67.58 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.171 -0.468 . . . . 75.25 110.906 179.928 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 38.3 t0 -74.63 -49.96 19.55 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.22 -0.446 . . . . 52.11 110.865 -179.996 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 14.6 ptm -66.92 -42.49 85.29 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.212 -0.449 . . . . 64.44 110.894 179.976 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 97.1 mt -65.83 -38.11 81.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.149 -0.478 . . . . 61.54 111.12 179.97 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 33.6 m-20 -62.28 -36.17 81.25 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.18 -0.464 . . . . 65.15 110.847 179.959 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 24.9 mm-40 -63.62 -29.73 70.94 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.216 -0.447 . . . . 64.34 110.9 -179.963 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.516 HG13 ' CE1' ' M' ' 29' ' ' TYR . 9.7 m -105.34 12.68 8.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.151 -0.477 . . . . 74.44 111.114 179.967 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 30.7 t0 -90.01 98.73 11.94 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.232 -0.44 . . . . 73.0 110.857 179.953 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.34 -44.71 10.59 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.21 -0.45 . . . . 32.45 111.1 179.957 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 41.2 p30 -82.93 -0.2 47.43 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.219 -0.446 . . . . 74.14 110.837 -179.999 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 55.2 55.34 28.78 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.731 -0.747 . . . . 62.4 112.477 -179.927 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 48.7 p-10 -114.64 -15.74 11.92 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.891 0.376 . . . . 72.22 110.867 -179.895 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 92.71 19.14 38.39 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.799 -0.715 . . . . 62.41 112.478 179.96 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' THR . . . . . 0.698 HG21 HG22 ' A' ' 28' ' ' THR . 26.7 p -146.52 165.91 28.04 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.749 0.309 . . . . 43.24 111.148 -179.881 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.434 HD13 HD21 ' M' ' 31' ' ' LEU . 18.5 mt -96.23 109.43 22.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.219 -0.446 . . . . 72.33 111.132 179.915 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -74.04 -177.81 3.06 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.205 -0.452 . . . . 65.41 110.901 179.839 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.533 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 2.5 t80 -61.6 -58.35 18.98 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.636 0.731 . . . . 60.44 110.891 -179.886 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 66' ' ' PRO . . . . . 0.533 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 53.9 Cg_endo -69.78 -29.73 23.3 Favored 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.668 2.245 . . . . 65.51 112.299 -179.991 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 80.6 mt-10 -58.57 -40.02 81.95 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.268 -0.424 . . . . 73.02 110.868 -179.963 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 50.4 t80 -73.79 -36.05 65.0 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.119 -0.491 . . . . 72.4 110.894 -179.923 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 16.4 tp -68.84 -53.84 19.12 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.177 -0.465 . . . . 73.25 110.932 -179.976 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 14.1 t -52.9 -28.45 23.34 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.214 -0.448 . . . . 74.12 111.154 179.964 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 39.6 ttp -65.24 -42.46 93.35 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.231 -0.441 . . . . 71.43 110.873 179.876 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -71.97 -35.75 69.61 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.218 -0.447 . . . . 62.23 110.848 179.975 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -74.8 -29.62 61.15 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.237 -0.438 . . . . 70.43 111.078 179.926 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 16.6 ttm180 -64.84 -25.59 67.97 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.209 -0.45 . . . . 72.52 110.884 -179.887 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -51.96 -30.48 24.92 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.186 -0.461 . . . . 33.42 110.864 179.95 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 41.3 mtt -51.94 -41.56 62.14 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.272 -0.422 . . . . 73.25 110.893 179.886 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 7.1 mtmm -146.93 126.83 13.55 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.238 -0.437 . . . . 70.22 110.895 179.934 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -150.09 -74.68 0.16 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.215 -0.448 . . . . 75.15 110.857 179.859 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 13.5 t -112.4 161.96 16.1 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.162 -0.472 . . . . 65.53 111.154 -179.917 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 9.2 t0 71.66 2.64 4.36 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.244 -0.435 . . . . 72.41 110.819 179.901 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 70.9 m -80.14 -39.58 29.14 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.215 -0.448 . . . . 62.41 110.866 -179.778 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.7 ' HA ' HD12 ' A' ' 85' ' ' ILE . 3.4 tt0 -58.81 -38.49 78.72 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.17 -0.468 . . . . 73.31 110.853 -179.895 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -58.22 -44.15 88.06 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.167 -0.47 . . . . 61.31 110.865 -179.931 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -65.69 -32.99 74.85 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.207 -0.451 . . . . 74.45 110.895 -179.912 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.7 HD12 ' HA ' ' A' ' 82' ' ' GLU . 51.4 mt -68.19 -50.96 53.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.11 -0.495 . . . . 74.14 111.181 179.928 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 51.2 ttt180 -66.04 -33.5 75.94 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.131 -0.486 . . . . 75.21 110.847 179.969 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.681 ' O ' HG23 ' A' ' 91' ' ' VAL . 0.3 OUTLIER -76.41 -34.94 58.8 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.241 -0.436 . . . . 70.42 110.878 -179.912 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 88' ' ' ALA . . . . . 0.418 ' HB1' ' CE2' ' A' ' 92' ' ' PHE . . . -76.62 -34.49 58.35 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.149 -0.478 . . . . 45.04 111.086 179.94 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -61.57 -48.63 80.08 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.216 -0.447 . . . . 71.54 110.879 -179.936 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 12.9 ptm180 -60.76 -25.93 66.85 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.168 -0.469 . . . . 73.24 110.865 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 91' ' ' VAL . . . . . 0.681 HG23 ' O ' ' A' ' 87' ' ' GLU . 94.0 t -75.58 -51.21 21.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.234 -0.439 . . . . 73.05 111.136 179.98 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.455 ' CE1' HG11 ' A' ' 108' ' ' VAL . 8.9 m-85 -70.79 -26.61 63.4 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.184 -0.462 . . . . 73.41 110.882 -179.983 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 33.1 t0 -76.52 88.91 3.26 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.157 -0.474 . . . . 71.13 110.864 179.954 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 59.4 mmtt -75.31 -51.04 14.17 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.203 -0.453 . . . . 72.33 110.914 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 31.2 p30 -72.58 -9.08 58.15 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.233 -0.439 . . . . 51.52 110.882 179.857 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 59.96 27.72 65.06 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.765 -0.731 . . . . 73.42 112.527 -179.9 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 44.7 p-10 -82.88 -16.12 48.79 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.899 0.38 . . . . 74.5 110.909 -179.878 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 89.08 18.72 53.22 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.752 -0.737 . . . . 73.23 112.491 179.981 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 20.2 m-85 -137.51 152.39 49.44 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.824 0.345 . . . . 71.44 110.945 -179.798 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 65.2 mt -122.63 114.64 43.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.135 -0.484 . . . . 74.04 111.152 179.916 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 6.8 p -107.19 165.43 11.37 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.208 -0.451 . . . . 53.31 110.87 -179.926 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 102' ' ' ALA . . . . . 0.502 ' HB2' HG13 ' A' ' 125' ' ' ILE . . . -51.85 -29.83 21.21 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.136 -0.484 . . . . 50.31 111.11 179.904 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -68.92 -43.11 75.83 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.191 -0.459 . . . . 61.02 111.096 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 83.5 mt-10 -76.8 -49.4 15.95 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.185 -0.461 . . . . 55.55 110.916 -179.956 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 24.3 tp -53.31 -47.62 69.1 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.187 -0.46 . . . . 72.34 110.891 -179.981 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 106' ' ' ARG . . . . . 0.75 ' HB2' HG21 ' A' ' 121' ' ' VAL . 46.9 ttp180 -53.02 -31.31 40.45 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.219 -0.446 . . . . 73.52 110.887 179.954 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 63.0 t60 -69.27 -34.41 74.72 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.168 -0.469 . . . . 74.14 110.889 179.977 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.455 HG11 ' CE1' ' A' ' 92' ' ' PHE . 45.3 t -70.0 -32.24 50.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.238 -0.437 . . . . 75.42 111.113 -179.989 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 7.8 mmt -73.09 -43.75 61.36 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.158 -0.473 . . . . 63.33 110.844 179.931 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -54.99 -41.13 70.86 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.243 -0.435 . . . . 71.31 111.145 -179.907 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 61.0 m-20 -71.57 -32.24 67.86 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.203 -0.453 . . . . 72.41 110.88 179.997 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 5.0 mt -70.75 -25.75 63.05 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.148 -0.478 . . . . 75.44 110.923 179.959 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 101.07 32.42 5.3 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.787 -0.72 . . . . 65.21 112.454 179.88 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -113.75 109.97 19.42 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.896 0.379 . . . . 72.25 110.875 -179.861 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 115' ' ' LYS . . . . . 0.418 ' O ' HD23 ' A' ' 116' ' ' LEU . 0.6 OUTLIER -66.61 108.08 2.32 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.159 -0.473 . . . . 63.53 110.876 179.984 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.603 HD22 ' HG2' ' A' ' 120' ' ' GLU . 10.4 mt -143.63 160.38 40.77 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.218 -0.446 . . . . 55.11 110.954 179.894 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 117' ' ' THR . . . . . 0.557 ' O ' HG23 ' A' ' 121' ' ' VAL . 31.9 p -118.86 177.01 5.01 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.217 -0.447 . . . . 73.2 111.139 179.986 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -57.05 -43.74 82.3 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.245 -0.434 . . . . 65.3 110.845 179.938 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -65.0 -33.44 76.06 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.212 -0.449 . . . . 71.31 110.845 -179.87 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 120' ' ' GLU . . . . . 0.603 ' HG2' HD22 ' A' ' 116' ' ' LEU . 1.2 tp10 -70.12 -43.92 70.0 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.143 -0.48 . . . . 72.25 110.926 -179.974 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.75 HG21 ' HB2' ' A' ' 106' ' ' ARG . 48.6 t -59.19 -31.94 47.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.155 -0.475 . . . . 54.4 111.114 179.976 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 11.7 t0 -52.01 -42.77 63.28 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.226 -0.443 . . . . 74.04 110.856 179.916 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -55.76 -32.65 63.61 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.179 -0.464 . . . . 73.5 110.895 -179.909 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 30.8 mtp -76.05 -59.17 2.88 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.164 -0.471 . . . . 71.11 110.882 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.502 HG13 ' HB2' ' A' ' 102' ' ' ALA . 36.0 mm -53.92 -35.73 28.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.218 -0.446 . . . . 73.5 111.12 179.931 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 24.0 ttm180 -63.44 -31.85 73.13 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.178 -0.464 . . . . 74.15 110.898 179.944 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 21.0 tp10 -74.75 -52.38 11.68 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.161 -0.472 . . . . 72.21 110.842 -179.901 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.653 ' HB3' HG22 ' A' ' 136' ' ' VAL . . . -65.21 -34.41 78.3 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.159 -0.473 . . . . 75.33 111.088 179.982 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 49.4 t0 -68.42 86.74 0.3 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.217 -0.447 . . . . 51.33 110.882 179.968 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 60.6 mt -79.81 -46.15 22.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.172 -0.467 . . . . 71.52 111.126 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 21.2 p30 -72.78 -8.7 56.7 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.151 -0.477 . . . . 51.44 110.874 179.864 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 62.7 42.97 99.61 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.692 -0.766 . . . . 70.2 112.505 -179.933 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 34.6 p-10 -88.05 -15.98 34.84 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.825 0.345 . . . . 71.3 110.877 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 103.98 2.41 45.58 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.761 -0.733 . . . . 73.13 112.501 -179.935 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -149.15 172.26 15.11 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.829 0.347 . . . . 74.14 110.939 -179.88 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 136' ' ' VAL . . . . . 0.653 HG22 ' HB3' ' A' ' 128' ' ' ALA . 95.6 t -107.8 111.06 34.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.204 -0.453 . . . . 74.2 111.127 179.939 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 44.2 p-10 -92.82 165.95 12.66 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.153 -0.476 . . . . 64.11 110.88 -179.967 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 138' ' ' TYR . . . . . 0.518 ' O ' HG23 ' A' ' 142' ' ' VAL . 58.9 t80 -51.97 -46.47 64.84 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.207 -0.451 . . . . 75.11 110.905 -179.906 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 -51.99 -40.89 61.65 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.113 -0.494 . . . . 72.15 110.867 -179.956 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 20.7 mt-10 -78.34 -39.81 38.36 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.2 -0.455 . . . . 62.44 110.876 -179.926 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 52.4 t80 -61.17 -38.66 87.29 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.15 -0.477 . . . . 74.44 110.87 -179.888 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 142' ' ' VAL . . . . . 0.518 HG23 ' O ' ' A' ' 138' ' ' TYR . 93.8 t -71.26 -37.95 68.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.119 -0.491 . . . . 54.44 111.11 179.961 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 3.4 tp-100 -71.56 -31.25 66.79 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.185 -0.461 . . . . 54.21 110.895 -179.955 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 9.0 tpt -74.7 -42.43 58.39 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.193 -0.458 . . . . 73.54 110.867 179.964 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 9.6 ttm -79.34 -26.07 42.19 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.236 -0.438 . . . . 71.34 110.875 179.967 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 2.6 m -110.75 21.26 16.73 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.23 -0.441 . . . . 62.21 111.14 -179.924 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -60.47 -170.51 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.245 -0.434 . . . . 33.2 111.086 179.894 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 7.3 mmmm . . . . . 0 C--N 1.329 -0.32 0 CA-C-N 116.192 -0.458 . . . . 71.31 110.902 179.991 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' M' M ' 8' ' ' LEU . . . . . . . . . . . . . 9.3 mp . . . . . 0 C--O 1.231 0.08 0 CA-C-O 120.8 0.333 . . . . 61.24 110.91 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' M' M ' 9' ' ' SER . . . . . . . . . . . . . 12.2 p -155.92 177.82 10.98 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.151 -0.477 . . . . 71.43 110.821 -179.971 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' M' M ' 10' ' ' GLY . . . . . . . . . . . . . . . 161.87 146.06 4.53 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.782 -0.723 . . . . 63.12 112.521 -179.981 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' M' M ' 11' ' ' GLY . . . . . . . . . . . . . . . 100.59 -33.69 6.18 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.744 -0.741 . . . . 72.1 112.465 -179.964 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' M' M ' 12' ' ' GLU . . . . . . . . . . . . . 54.4 mt-10 -87.27 -179.14 6.36 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.886 0.375 . . . . 74.43 110.869 -179.865 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' M' M ' 13' ' ' LEU . . . . . 0.403 HD22 ' HA ' ' M' ' 13' ' ' LEU . 0.8 OUTLIER -87.79 75.81 8.86 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.133 -0.485 . . . . 71.32 110.91 -179.965 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' M' M ' 14' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -102.87 26.11 8.5 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.152 -0.476 . . . . 75.33 110.891 179.794 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' M' M ' 15' ' ' LYS . . . . . . . . . . . . . 60.9 mttp -66.17 -57.16 8.23 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.223 -0.444 . . . . 73.23 110.894 179.986 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' M' M ' 16' ' ' TRP . . . . . 0.468 ' CE3' HD12 ' M' ' 19' ' ' ILE . 19.7 m95 -54.34 -39.31 66.96 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.244 -0.434 . . . . 71.45 110.862 179.983 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' M' M ' 17' ' ' GLU . . . . . . . . . . . . . 41.0 tp10 -56.45 -26.81 54.97 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.243 -0.435 . . . . 62.42 110.883 -179.974 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' M' M ' 18' ' ' LYS . . . . . . . . . . . . . 6.9 ttpm? -78.61 -25.87 45.21 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.171 -0.468 . . . . 73.21 110.897 179.984 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' M' M ' 19' ' ' ILE . . . . . 0.468 HD12 ' CE3' ' M' ' 16' ' ' TRP . 29.6 mt -89.88 -25.22 5.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.187 -0.46 . . . . 71.11 111.14 179.874 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' M' M ' 20' ' ' ARG . . . . . . . . . . . . . 22.5 ttt180 -54.37 -40.21 67.91 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.174 -0.466 . . . . 73.44 110.903 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' M' M ' 21' ' ' LEU . . . . . . . . . . . . . 4.1 mt 52.91 -170.33 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.164 -0.471 . . . . 71.21 110.942 -179.997 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' M' M ' 22' ' ' ARG . . . . . . . . . . . . . 3.0 mmt180 60.01 79.39 0.3 Allowed Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.595 0.712 . . . . 73.31 110.914 179.952 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' M' M ' 23' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.76 -28.0 25.79 Favored 'Trans proline' 0 C--N 1.342 0.204 0 C-N-CA 122.705 2.27 . . . . 72.34 112.358 -179.967 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' M' M ' 24' ' ' GLY . . . . . . . . . . . . . . . -150.68 169.07 30.52 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.78 -0.724 . . . . 40.54 112.489 179.986 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' M' M ' 25' ' ' GLY . . . . . . . . . . . . . . . -105.12 -118.96 4.54 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.725 -0.75 . . . . 62.34 112.445 -179.871 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' M' M ' 26' ' ' LYS . . . . . . . . . . . . . 6.0 ttpm? -148.18 -74.23 0.19 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.842 0.353 . . . . 74.22 110.891 -179.988 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' M' M ' 27' ' ' LYS . . . . . . . . . . . . . 17.0 ttpt -176.25 133.19 0.24 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.253 -0.43 . . . . 74.43 110.902 179.851 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' M' M ' 28' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -176.36 52.63 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.214 -0.448 . . . . 71.43 110.88 179.941 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' M' M ' 29' ' ' TYR . . . . . 0.516 ' CE1' HG13 ' A' ' 55' ' ' VAL . 0.3 OUTLIER -154.88 -47.08 0.08 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.216 -0.447 . . . . 60.33 110.969 -179.894 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' M' M ' 30' ' ' LYS . . . . . . . . . . . . . 3.0 ttmm 61.15 27.35 17.15 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.092 -0.504 . . . . 74.24 110.892 179.888 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' M' M ' 31' ' ' LEU . . . . . 0.434 HD21 HD13 ' A' ' 63' ' ' ILE . 9.5 tp -127.33 -52.28 1.39 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.196 -0.456 . . . . 75.44 110.933 179.926 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' M' M ' 32' ' ' LYS . . . . . . . . . . . . . 3.2 ttpp -47.65 -47.08 29.41 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.212 -0.449 . . . . 63.54 110.918 179.792 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' M' M ' 33' ' ' HIS . . . . . . . . . . . . . 74.8 t60 -50.45 -39.87 48.93 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.201 -0.454 . . . . 70.11 110.838 179.924 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' M' M ' 34' ' ' ILE . . . . . . . . . . . . . 50.1 mt -50.73 -39.27 18.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.236 -0.438 . . . . 65.42 111.123 -180.0 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' M' M ' 35' ' ' VAL . . . . . . . . . . . . . 61.1 t -49.27 -39.93 13.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.194 -0.457 . . . . 75.52 111.098 179.895 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' M' M ' 36' ' ' TRP . . . . . . . . . . . . . 22.8 m0 -59.02 -39.5 82.12 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.168 -0.469 . . . . 71.51 110.95 179.958 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' M' M ' 37' ' ' ALA . . . . . 0.98 ' HB3' HD13 ' A' ' 39' ' ' LEU . . . -63.71 -18.69 64.28 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.205 -0.452 . . . . 74.25 111.069 179.874 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' M' M ' 38' ' ' SER . . . . . 0.64 ' HB3' HD23 ' A' ' 18' ' ' LEU . 1.2 m -69.3 -17.96 63.78 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.24 -0.436 . . . . 72.5 110.871 -179.769 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' M' M ' 39' ' ' ARG . . . . . . . . . . . . . 26.4 ptt180 -56.11 -25.38 45.64 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.107 -0.497 . . . . 74.15 110.877 -179.916 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' M' M ' 40' ' ' GLU . . . . . . . . . . . . . 41.6 mm-40 -88.1 -47.99 8.07 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.188 -0.46 . . . . 42.34 110.914 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' M' M ' 41' ' ' LEU . . . . . . . . . . . . . 12.9 mt -60.39 168.4 2.1 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.165 -0.47 . . . . 70.31 110.97 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' M' M ' 42' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -156.95 -48.65 0.07 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.174 -0.466 . . . . 75.11 110.896 179.945 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' M' M ' 43' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.321 0 CA-C-N 116.153 -0.476 . . . . 54.41 110.859 -179.956 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 241' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 262' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 301' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 322' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.085 0 CA-C-O 120.806 0.336 . . . . 60.2 111.1 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -105.35 -175.67 2.86 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.197 -0.456 . . . . 73.25 110.845 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' GLN . . . . . 0.523 ' O ' HD23 ' A' ' 4' ' ' LEU . 31.8 mm-40 -74.23 -74.51 0.19 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.202 -0.454 . . . . 71.51 110.893 -179.879 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.523 HD23 ' O ' ' A' ' 3' ' ' GLN . 7.7 mt -134.18 149.96 51.06 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.155 -0.475 . . . . 73.32 110.932 179.998 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 31.2 p -119.01 177.73 4.76 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.202 -0.454 . . . . 71.13 111.151 179.924 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 11.9 tm-20 -56.46 -30.09 62.48 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.231 -0.44 . . . . 73.42 110.87 -179.949 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 58.2 tt0 -67.47 -39.92 85.31 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.164 -0.471 . . . . 74.12 110.879 -179.931 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 8.0 tp60 -77.78 -36.78 50.09 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.165 -0.47 . . . . 71.03 110.908 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 59.4 mt -72.56 -38.39 59.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.199 -0.455 . . . . 72.22 111.088 179.989 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -65.91 -27.02 67.88 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.228 -0.442 . . . . 54.31 111.137 179.807 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 20.6 mm-40 -74.83 -44.75 47.56 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.173 -0.467 . . . . 65.23 110.9 -179.933 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 23.8 m-85 -75.26 -45.81 37.68 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.157 -0.474 . . . . 61.02 110.853 -179.913 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 27.0 ttmt -56.36 -44.53 80.2 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.149 -0.478 . . . . 73.34 110.888 179.976 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -52.99 -32.65 47.61 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.202 -0.454 . . . . 72.4 110.84 -179.993 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -67.51 -42.2 83.23 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.193 -0.458 . . . . 72.04 111.109 179.916 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 66.6 t80 -56.07 -53.51 56.18 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.199 -0.455 . . . . 61.32 110.899 -179.914 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 70.9 m -55.85 -27.21 50.54 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.141 -0.481 . . . . 41.23 110.855 -179.796 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 15.5 tp -67.77 -40.25 84.04 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.182 -0.463 . . . . 71.35 110.947 179.964 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.672 ' HA ' HG21 ' A' ' 35' ' ' VAL . 59.5 m-85 -82.43 -34.48 28.2 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.228 -0.442 . . . . 75.11 110.853 179.93 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 11.0 t0 -69.47 98.52 1.12 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.192 -0.458 . . . . 64.21 110.859 -179.999 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 45.4 mmtt -72.09 -56.14 6.12 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.169 -0.469 . . . . 63.24 110.869 -179.978 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 26.5 p-10 -73.94 -10.01 59.22 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.2 -0.455 . . . . 53.41 110.876 179.893 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 51.99 44.6 56.41 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.762 -0.732 . . . . 74.13 112.529 -179.9 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 26.5 p-10 -88.51 -15.77 34.41 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.878 0.371 . . . . 72.53 110.89 -179.979 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 104.67 -11.72 50.08 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.74 -0.743 . . . . 72.02 112.47 -179.953 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 20.7 p -131.04 130.68 43.58 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.715 0.293 . . . . 74.31 111.166 -179.851 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 21.2 mt -90.47 130.84 39.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.292 -0.413 . . . . 62.44 111.096 179.919 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 29.8 p -108.75 -176.83 3.15 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.188 -0.46 . . . . 73.13 111.141 179.963 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.512 HG23 HD12 ' A' ' 52' ' ' ILE . 7.6 p -65.61 -41.5 92.69 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.247 -0.433 . . . . 73.21 111.126 -179.985 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 79.8 mttt -68.23 -50.15 55.91 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.206 -0.452 . . . . 73.15 110.902 179.935 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 27.4 mt-10 -56.36 -32.65 64.94 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.187 -0.461 . . . . 72.04 110.882 179.992 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.559 HD13 ' O ' ' A' ' 32' ' ' LEU . 0.9 OUTLIER -73.13 -43.14 62.07 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.156 -0.475 . . . . 50.23 110.926 179.988 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -69.73 -27.86 72.77 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.742 -0.742 . . . . 73.22 112.448 179.933 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 46.6 m -64.68 -59.51 4.18 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.841 0.353 . . . . 42.13 111.177 -179.896 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.672 HG21 ' HA ' ' A' ' 19' ' ' PHE . 99.9 t -57.38 -50.35 77.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.233 -0.439 . . . . 64.43 111.169 179.864 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 1.9 ttt -55.08 -30.42 59.63 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.166 -0.47 . . . . 75.11 110.907 179.88 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 23.9 ttm180 -60.1 -50.67 72.8 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.223 -0.444 . . . . 73.53 110.9 -179.96 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' SER . . . . . 0.587 ' OG ' HD21 ' M' ' 41' ' ' LEU . 1.6 t -61.34 -26.17 67.64 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.16 -0.473 . . . . 63.04 110.853 -179.751 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 1.0 HD13 ' HB3' ' M' ' 37' ' ' ALA . 58.2 mt -73.84 -20.5 60.42 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.096 -0.502 . . . . 71.15 110.93 179.963 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 101.5 29.62 6.21 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.715 -0.755 . . . . 75.23 112.467 179.886 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 10.5 mm-40 -127.46 133.97 49.87 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.796 0.331 . . . . 73.12 110.918 -179.882 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 10.7 t-20 -109.27 86.24 4.03 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.609 0.718 . . . . 70.13 110.875 -179.984 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.78 167.89 23.16 Favored 'Trans proline' 0 C--O 1.231 0.167 0 C-N-CA 122.709 2.272 . . . . 75.03 112.306 179.934 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 19.3 p -111.79 156.49 21.89 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.187 -0.461 . . . . 54.24 111.152 179.997 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 12.3 tp10 -51.97 -40.81 61.47 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.244 -0.435 . . . . 74.23 110.882 179.973 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.32 -39.37 65.33 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.159 -0.473 . . . . 40.04 111.109 179.943 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -60.47 -52.58 64.58 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.258 -0.428 . . . . 71.04 110.886 -179.924 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.43 ' CD2' HD12 ' A' ' 32' ' ' LEU . 19.7 mt -55.27 -48.52 73.89 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.163 -0.471 . . . . 74.22 110.89 -179.956 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.84 -41.94 71.33 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.196 -0.456 . . . . 40.02 110.894 179.977 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 51.0 t0 -57.99 -43.2 86.45 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.175 -0.466 . . . . 72.04 110.878 179.949 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 5.8 mtp -62.9 -55.36 26.75 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.205 -0.452 . . . . 72.33 110.873 179.989 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.512 HD12 HG23 ' A' ' 29' ' ' THR . 65.5 mt -53.24 -53.66 22.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.201 -0.454 . . . . 75.23 111.144 179.95 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 53' ' ' ASN . . . . . 0.403 HD21 ' HA ' ' A' ' 53' ' ' ASN . 0.2 OUTLIER -61.73 -37.67 85.06 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.203 -0.453 . . . . 71.22 110.88 179.936 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 -60.02 -33.16 71.64 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.163 -0.471 . . . . 72.31 110.914 179.986 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.489 HG11 ' SD ' ' A' ' 71' ' ' MET . 32.8 m -109.97 20.2 6.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.126 -0.488 . . . . 71.31 111.141 179.95 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 29.3 t0 -90.11 99.15 12.22 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.157 -0.474 . . . . 63.3 110.83 179.947 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.35 -40.19 13.76 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.163 -0.471 . . . . 63.43 111.071 179.956 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 13.0 p-10 -86.64 -0.12 55.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.235 -0.439 . . . . 74.42 110.859 179.981 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 52.46 56.81 15.8 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.738 -0.744 . . . . 71.21 112.504 -179.911 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 52.1 p-10 -114.48 -15.89 11.99 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.877 0.37 . . . . 71.12 110.921 -179.93 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' GLY . . . . . 0.498 ' O ' HG21 ' A' ' 52' ' ' ILE . . . 91.65 17.79 47.38 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.695 -0.764 . . . . 64.21 112.445 179.981 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 25.1 p -150.49 162.38 40.71 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.721 0.296 . . . . 75.24 111.168 -179.814 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.419 HG21 ' HD1' ' A' ' 68' ' ' PHE . 20.3 mt -97.86 109.39 23.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.242 -0.435 . . . . 74.11 111.121 179.941 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -75.84 -172.69 2.01 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.218 -0.447 . . . . 73.43 110.864 179.878 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.535 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 2.5 t80 -64.91 -58.15 13.77 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.644 0.735 . . . . 74.54 110.909 -179.948 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 66' ' ' PRO . . . . . 0.535 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 54.3 Cg_endo -69.71 -27.83 26.25 Favored 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.669 2.246 . . . . 51.32 112.364 179.977 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 14.0 mt-10 -59.75 -41.06 90.13 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.221 -0.445 . . . . 73.24 110.864 -179.939 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' PHE . . . . . 0.419 ' HD1' HG21 ' A' ' 63' ' ' ILE . 24.0 t80 -73.99 -36.11 64.49 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.164 -0.471 . . . . 63.31 110.924 -179.982 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 24.0 tp -68.14 -53.89 21.92 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.141 -0.481 . . . . 74.42 110.921 -179.987 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 14.8 t -54.92 -30.85 59.47 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.2 -0.455 . . . . 64.23 111.124 179.972 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' MET . . . . . 0.489 ' SD ' HG11 ' A' ' 55' ' ' VAL . 44.1 ttp -58.94 -38.3 78.69 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.216 -0.447 . . . . 73.42 110.86 179.919 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -75.65 -36.66 60.09 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.214 -0.448 . . . . 63.14 110.884 179.965 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -60.14 -30.75 69.51 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.224 -0.444 . . . . 70.13 111.085 179.92 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 14.1 tpp180 -63.58 -19.88 65.19 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.248 -0.433 . . . . 65.32 110.912 -179.974 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -51.71 -32.09 28.85 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.197 -0.456 . . . . 71.22 110.859 -179.972 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -89.95 -25.04 21.11 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.197 -0.456 . . . . 73.03 110.9 179.895 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 52.6 mttt -71.29 -74.76 0.14 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.207 -0.451 . . . . 73.33 110.867 179.934 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -179.35 108.14 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.207 -0.451 . . . . 65.54 110.896 179.899 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -150.8 68.03 0.94 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.22 -0.446 . . . . 64.32 111.148 -179.864 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -117.46 -28.63 6.04 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.239 -0.437 . . . . 72.53 110.862 179.906 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 16.9 m -56.85 -27.64 60.59 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.215 -0.448 . . . . 54.44 110.838 -179.764 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -96.85 -26.53 15.06 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.141 -0.481 . . . . 74.03 110.879 -179.942 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 11.8 tm-20 -75.52 -34.19 60.78 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.163 -0.471 . . . . 75.25 110.866 -179.923 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 20.3 tp10 -66.71 -28.46 68.45 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.171 -0.468 . . . . 71.05 110.911 -179.94 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 76.5 mt -74.55 -48.71 33.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.128 -0.487 . . . . 55.34 111.11 179.98 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 25.9 ttt85 -71.44 -42.27 68.43 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.138 -0.483 . . . . 73.44 110.859 179.962 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.742 ' O ' HG23 ' A' ' 91' ' ' VAL . 18.0 tt0 -62.31 -56.93 13.67 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.215 -0.448 . . . . 61.14 110.89 -179.896 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 88' ' ' ALA . . . . . 0.469 ' HB1' ' CE2' ' A' ' 92' ' ' PHE . . . -53.35 -51.03 63.75 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.152 -0.476 . . . . 74.21 111.082 179.935 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 17.1 t80 -53.16 -43.41 67.03 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.2 -0.455 . . . . 73.14 110.933 -179.928 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 59.6 ttp180 -69.19 -34.29 74.69 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.127 -0.488 . . . . 72.13 110.846 -179.886 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 91' ' ' VAL . . . . . 0.742 HG23 ' O ' ' A' ' 87' ' ' GLU . 96.1 t -66.07 -40.73 88.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.139 -0.482 . . . . 74.1 111.167 179.967 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.469 ' CE2' ' HB1' ' A' ' 88' ' ' ALA . 8.3 m-85 -76.81 -31.92 57.27 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.129 -0.487 . . . . 75.13 110.843 -179.972 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 21.5 t0 -71.29 85.4 0.79 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.158 -0.473 . . . . 54.32 110.869 -180.0 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 11.5 ptpt -78.72 -40.58 33.25 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.175 -0.466 . . . . 74.33 110.876 -179.995 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 55.2 p-10 -75.01 -9.17 58.28 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.202 -0.454 . . . . 60.43 110.842 179.883 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 59.55 26.81 62.72 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.74 -0.743 . . . . 71.34 112.504 -179.885 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 35.8 p-10 -84.22 -16.13 44.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.879 0.371 . . . . 71.34 110.888 -179.901 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 80.98 18.26 70.25 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.744 -0.741 . . . . 70.55 112.482 -179.996 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 20.7 m-85 -140.83 142.24 34.61 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.84 0.352 . . . . 72.14 110.948 -179.789 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 62.3 mt -103.48 126.44 57.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.172 -0.467 . . . . 75.11 111.12 179.913 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 93.0 p -107.28 -175.63 2.84 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.193 -0.458 . . . . 70.4 110.896 -179.942 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 102' ' ' ALA . . . . . 0.66 ' O ' HG11 ' A' ' 121' ' ' VAL . . . -73.27 -31.56 64.16 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.115 -0.493 . . . . 74.21 111.088 179.928 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -71.07 -47.08 60.41 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.234 -0.439 . . . . 72.12 111.087 179.935 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 104' ' ' GLU . . . . . 0.43 ' O ' HG23 ' A' ' 108' ' ' VAL . 69.9 mt-10 -69.16 -44.02 73.12 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.254 -0.43 . . . . 75.51 110.917 -179.914 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 35.8 tp -53.42 -42.32 66.94 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.104 -0.498 . . . . 62.53 110.928 -179.989 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 106' ' ' ARG . . . . . 0.605 ' HB2' HG21 ' A' ' 121' ' ' VAL . 8.9 ttt-85 -63.98 -49.33 72.94 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.223 -0.444 . . . . 73.53 110.858 179.975 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 18.9 t60 -54.22 -34.39 60.52 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.212 -0.449 . . . . 61.35 110.877 179.951 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.43 HG23 ' O ' ' A' ' 104' ' ' GLU . 95.2 t -73.34 -29.98 29.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.194 -0.457 . . . . 71.21 111.098 179.995 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 44.4 tpp -73.29 -53.76 10.06 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.226 -0.443 . . . . 63.14 110.884 179.939 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 2.1 t -51.75 -30.18 21.66 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.198 -0.455 . . . . 75.44 111.13 -179.923 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 6.7 m120 -65.06 -37.45 87.6 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.2 -0.455 . . . . 55.43 110.932 179.979 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 17.3 mt -72.12 -9.72 58.8 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.182 -0.463 . . . . 62.13 110.916 179.919 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 101.08 29.18 6.53 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.736 -0.745 . . . . 74.44 112.503 179.923 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 12.4 tp10 -133.01 110.06 9.98 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.953 0.406 . . . . 72.44 110.885 -179.907 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 31.0 tttt -85.69 120.42 27.1 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.133 -0.485 . . . . 73.32 110.879 179.96 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.801 HD22 ' HG2' ' A' ' 120' ' ' GLU . 61.1 mt -124.54 153.58 41.9 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.191 -0.459 . . . . 74.32 110.921 179.895 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 45.5 p -89.55 162.83 15.47 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.18 -0.464 . . . . 65.22 111.154 179.964 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 94.7 m-20 -53.56 -38.78 64.19 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.206 -0.452 . . . . 41.41 110.882 179.935 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -68.23 -34.3 75.98 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.186 -0.461 . . . . 73.22 110.92 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 120' ' ' GLU . . . . . 0.801 ' HG2' HD22 ' A' ' 116' ' ' LEU . 19.9 tp10 -67.12 -42.3 84.75 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.117 -0.492 . . . . 73.22 110.902 -179.962 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.66 HG11 ' O ' ' A' ' 102' ' ' ALA . 63.6 t -60.34 -34.54 57.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.124 -0.489 . . . . 64.41 111.127 179.976 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -51.95 -46.95 64.95 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.199 -0.455 . . . . 63.13 110.837 179.92 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 35.2 tp10 -57.6 -29.26 64.36 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.214 -0.448 . . . . 75.3 110.867 -179.875 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 35.4 mtp -75.96 -58.06 3.5 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.162 -0.472 . . . . 73.05 110.862 -179.996 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 33.3 mm -54.0 -35.31 28.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.213 -0.449 . . . . 73.31 111.109 179.982 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 51.8 ttm-85 -69.01 -31.72 70.75 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.199 -0.455 . . . . 71.12 110.897 179.952 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -69.01 -40.5 78.65 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.134 -0.485 . . . . 72.55 110.888 -179.944 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.522 ' HB3' HG22 ' A' ' 136' ' ' VAL . . . -83.82 -27.34 28.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.133 -0.485 . . . . 73.33 111.105 179.946 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 50.7 t0 -74.54 86.6 2.09 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.21 -0.45 . . . . 73.34 110.881 179.944 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 90.1 mt -80.08 -45.57 22.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.239 -0.437 . . . . 61.41 111.152 179.966 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 16.6 p30 -71.43 -8.93 57.05 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.152 -0.476 . . . . 54.41 110.83 179.916 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 63.13 43.01 99.33 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.711 -0.756 . . . . 30.42 112.49 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 17.2 p-10 -88.9 -15.91 33.2 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.864 0.364 . . . . 73.3 110.826 -179.934 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 100.36 5.33 54.45 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.721 -0.752 . . . . 63.41 112.434 -179.966 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -149.33 172.16 15.35 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.821 0.343 . . . . 74.42 110.918 -179.823 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 136' ' ' VAL . . . . . 0.522 HG22 ' HB3' ' A' ' 128' ' ' ALA . 98.4 t -113.63 115.97 51.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.234 -0.439 . . . . 65.22 111.097 -179.991 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 45.9 p-10 -93.87 167.83 11.37 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.183 -0.462 . . . . 73.11 110.862 179.978 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 138' ' ' TYR . . . . . 0.709 ' O ' HG23 ' A' ' 142' ' ' VAL . 61.3 t80 -53.2 -41.94 65.8 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.159 -0.473 . . . . 75.13 110.948 -179.958 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 22.9 tp10 -57.11 -40.62 77.43 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.119 -0.491 . . . . 63.14 110.927 180.0 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -78.52 -29.94 46.79 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.088 -0.505 . . . . 75.1 110.859 -179.934 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 53.7 t80 -71.97 -37.1 69.97 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.184 -0.462 . . . . 74.45 110.918 -179.938 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 142' ' ' VAL . . . . . 0.709 HG23 ' O ' ' A' ' 138' ' ' TYR . 85.7 t -64.74 -44.94 96.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.12 -0.491 . . . . 62.12 111.165 179.929 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 42.2 tt0 -63.04 -27.97 69.77 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.161 -0.472 . . . . 63.22 110.906 -179.988 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 3.9 tpt -74.61 -54.96 6.45 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.183 -0.462 . . . . 75.01 110.859 180.0 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 12.8 ttm -65.54 -27.23 68.3 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.217 -0.447 . . . . 60.43 110.871 179.951 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 1.3 m -108.74 21.33 17.4 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.243 -0.435 . . . . 63.35 111.149 -179.916 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -51.65 143.08 13.21 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.184 -0.462 . . . . 73.54 111.075 179.857 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 29.8 ttmt . . . . . 0 C--N 1.328 -0.34 0 CA-C-N 116.238 -0.437 . . . . 72.11 110.926 179.956 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' M' M ' 8' ' ' LEU . . . . . . . . . . . . . 2.6 pp . . . . . 0 C--O 1.231 0.108 0 CA-C-O 120.831 0.348 . . . . 72.04 110.924 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' M' M ' 9' ' ' SER . . . . . . . . . . . . . 16.6 m -117.69 -64.26 1.32 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.185 -0.461 . . . . 65.02 110.898 -179.979 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' M' M ' 10' ' ' GLY . . . . . . . . . . . . . . . 165.73 64.87 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.759 -0.734 . . . . 60.42 112.546 -180.0 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' M' M ' 11' ' ' GLY . . . . . . . . . . . . . . . 97.08 30.03 7.67 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.714 -0.755 . . . . 63.24 112.493 -179.867 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' M' M ' 12' ' ' GLU . . . . . . . . . . . . . 21.2 mt-10 -98.37 171.77 7.97 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.875 0.369 . . . . 73.44 110.862 -179.853 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' M' M ' 13' ' ' LEU . . . . . 0.409 HD22 ' HA ' ' M' ' 13' ' ' LEU . 0.9 OUTLIER -88.21 75.82 8.54 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.132 -0.485 . . . . 75.54 110.894 -179.949 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' M' M ' 14' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -103.03 26.1 8.6 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.203 -0.453 . . . . 74.45 110.838 179.857 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' M' M ' 15' ' ' LYS . . . . . 0.455 ' CD ' HD11 ' A' ' 116' ' ' LEU . 16.2 mttm -68.77 -46.04 69.81 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.199 -0.455 . . . . 73.43 110.904 179.958 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' M' M ' 16' ' ' TRP . . . . . . . . . . . . . 34.3 m95 -52.06 -39.08 59.12 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.257 -0.428 . . . . 70.14 110.872 179.977 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' M' M ' 17' ' ' GLU . . . . . . . . . . . . . 17.2 tt0 -55.73 -34.2 64.94 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.255 -0.429 . . . . 71.32 110.89 -179.977 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' M' M ' 18' ' ' LYS . . . . . . . . . . . . . 6.3 ttmm -68.52 -22.18 64.53 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.198 -0.456 . . . . 75.23 110.862 -179.995 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' M' M ' 19' ' ' ILE . . . . . . . . . . . . . 24.2 mm -69.76 -33.61 57.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.192 -0.458 . . . . 50.0 111.119 179.868 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' M' M ' 20' ' ' ARG . . . . . . . . . . . . . 35.0 ttp180 -51.86 -30.3 23.21 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.194 -0.457 . . . . 73.22 110.871 179.978 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' M' M ' 21' ' ' LEU . . . . . . . . . . . . . 5.5 mt 55.57 -175.67 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.158 -0.473 . . . . 61.04 110.905 -179.995 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' M' M ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -109.43 155.45 41.2 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.589 0.709 . . . . 72.33 110.87 179.954 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' M' M ' 23' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.83 174.07 10.11 Favored 'Trans proline' 0 C--N 1.341 0.147 0 C-N-CA 122.68 2.253 . . . . 73.23 112.316 -179.98 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' M' M ' 24' ' ' GLY . . . . . . . . . . . . . . . 112.04 69.33 0.55 Allowed Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.707 -0.759 . . . . 51.34 112.486 -179.984 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' M' M ' 25' ' ' GLY . . . . . . . . . . . . . . . -159.07 -148.21 5.12 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.703 -0.761 . . . . 65.14 112.488 -179.961 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' M' M ' 26' ' ' LYS . . . . . . . . . . . . . 13.3 tptm -73.51 160.7 31.3 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.88 0.371 . . . . 73.32 110.862 -179.971 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' M' M ' 27' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.27 147.37 31.53 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.191 -0.459 . . . . 65.13 110.933 179.856 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' M' M ' 28' ' ' GLN . . . . . . . . . . . . . 7.6 tp60 -176.58 126.18 0.18 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.238 -0.437 . . . . 74.05 110.925 -179.995 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' M' M ' 29' ' ' TYR . . . . . 0.472 ' CE1' HG12 ' A' ' 55' ' ' VAL . 5.0 t80 -63.48 -71.59 0.16 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.214 -0.448 . . . . 61.41 110.962 -179.877 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' M' M ' 30' ' ' LYS . . . . . . . . . . . . . 9.2 tttt 173.38 -46.44 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.114 -0.494 . . . . 64.32 110.88 179.869 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' M' M ' 31' ' ' LEU . . . . . 0.723 ' CD1' HD12 ' M' ' 34' ' ' ILE . 8.1 tp -96.47 -36.19 10.88 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.279 -0.418 . . . . 74.14 110.914 179.959 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' M' M ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -47.41 -34.4 7.11 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.139 -0.482 . . . . 63.24 110.886 179.855 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' M' M ' 33' ' ' HIS . . . . . . . . . . . . . 3.4 t60 -52.02 -45.78 64.72 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.212 -0.449 . . . . 74.23 110.868 179.926 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' M' M ' 34' ' ' ILE . . . . . 0.723 HD12 ' CD1' ' M' ' 31' ' ' LEU . 60.8 mt -51.82 -35.32 17.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.142 -0.481 . . . . 74.05 111.136 179.97 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' M' M ' 35' ' ' VAL . . . . . . . . . . . . . 46.2 t -49.95 -39.58 15.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.194 -0.457 . . . . 75.41 111.143 179.865 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' M' M ' 36' ' ' TRP . . . . . . . . . . . . . 18.3 m0 -58.79 -39.48 81.18 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.14 -0.482 . . . . 75.24 110.976 179.907 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' M' M ' 37' ' ' ALA . . . . . 1.0 ' HB3' HD13 ' A' ' 39' ' ' LEU . . . -63.85 -18.52 64.24 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.229 -0.441 . . . . 22.11 111.102 179.859 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' M' M ' 38' ' ' SER . . . . . . . . . . . . . 1.4 m -68.75 -17.81 64.11 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.242 -0.435 . . . . 62.03 110.842 -179.765 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' M' M ' 39' ' ' ARG . . . . . . . . . . . . . 51.3 mtp85 -51.73 -29.97 20.62 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.136 -0.484 . . . . 50.43 110.884 -179.968 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' M' M ' 40' ' ' GLU . . . . . . . . . . . . . 28.7 mm-40 -80.07 -47.28 15.09 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.192 -0.458 . . . . 74.32 110.908 -179.939 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' M' M ' 41' ' ' LEU . . . . . 0.587 HD21 ' OG ' ' A' ' 38' ' ' SER . 8.3 mt -61.01 176.62 0.4 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.108 -0.496 . . . . 61.04 110.932 -179.984 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' M' M ' 42' ' ' GLU . . . . . . . . . . . . . 16.5 tt0 -171.78 161.92 6.06 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.231 -0.44 . . . . 72.31 110.881 179.93 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' M' M ' 43' ' ' ARG . . . . . . . . . . . . . 11.0 mmm180 . . . . . 0 C--N 1.329 -0.3 0 CA-C-N 116.137 -0.483 . . . . 73.22 110.851 -179.887 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 241' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 262' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 301' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 322' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.146 0 CA-C-O 120.782 0.325 . . . . 54.44 111.05 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 4.0 p-10 -60.49 -38.46 84.39 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.287 -0.415 . . . . 71.25 110.837 179.999 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 69.21 -75.53 0.07 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.173 -0.467 . . . . 72.13 110.942 -179.891 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.633 HD22 ' HG2' ' A' ' 8' ' ' GLN . 9.1 mt -111.0 170.13 8.31 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.204 -0.453 . . . . 53.42 110.915 -179.998 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.64 ' O ' HD12 ' A' ' 9' ' ' ILE . 50.1 p -117.28 171.91 7.65 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.198 -0.456 . . . . 54.14 111.102 179.959 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 31.5 tt0 -53.63 -33.8 56.36 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.194 -0.457 . . . . 74.52 110.886 179.958 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 27.4 tt0 -60.77 -27.97 68.39 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.184 -0.462 . . . . 54.24 110.933 -179.963 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' GLN . . . . . 0.633 ' HG2' HD22 ' A' ' 4' ' ' LEU . 62.0 tp60 -78.02 -43.46 29.39 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.134 -0.485 . . . . 74.32 110.932 -179.975 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' ILE . . . . . 0.64 HD12 ' O ' ' A' ' 5' ' ' THR . 4.4 mp -71.41 -38.64 69.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.217 -0.447 . . . . 71.25 111.134 179.957 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -53.42 -40.13 64.88 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.154 -0.476 . . . . 75.45 111.127 179.795 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -74.65 -50.48 17.57 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.17 -0.468 . . . . 62.11 110.884 -179.927 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.591 ' CB ' HD13 ' A' ' 69' ' ' LEU . 16.5 m-85 -55.89 -37.62 69.08 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.16 -0.473 . . . . 62.01 110.904 -179.926 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 26.1 tttm -54.63 -37.27 65.43 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.155 -0.475 . . . . 75.31 110.935 179.916 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -68.24 -34.18 75.76 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.239 -0.437 . . . . 74.01 110.889 179.997 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -67.68 -28.21 67.49 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.141 -0.481 . . . . 32.53 111.082 179.934 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 91.0 t80 -75.64 -54.22 7.33 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.251 -0.432 . . . . 73.32 110.863 -179.897 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 9.4 t -54.32 -27.57 36.59 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.209 -0.451 . . . . 72.31 110.812 -179.769 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 16.3 tp -65.18 -38.87 91.89 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.179 -0.464 . . . . 71.13 110.928 -179.992 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.686 ' CD1' HG11 ' A' ' 35' ' ' VAL . 19.8 m-85 -81.46 -24.76 36.59 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.198 -0.455 . . . . 71.24 110.911 179.932 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 11.7 t0 -83.35 98.6 9.55 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.139 -0.482 . . . . 65.12 110.788 179.996 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 21.1 mmmt -67.27 -50.96 58.4 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.16 -0.473 . . . . 74.21 110.907 179.933 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 22.2 p-10 -80.93 -10.16 59.75 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.217 -0.447 . . . . 70.11 110.893 179.86 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 51.64 42.3 51.64 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.746 -0.74 . . . . 74.32 112.481 -179.969 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 34.1 p-10 -88.25 -15.15 36.64 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.838 0.351 . . . . 75.33 110.858 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 105.4 -11.18 47.13 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.711 -0.756 . . . . 33.55 112.502 -179.924 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 7.3 p -127.97 130.75 48.9 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.791 0.329 . . . . 71.5 111.162 -179.882 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.661 HG22 ' HB2' ' A' ' 32' ' ' LEU . 22.0 mt -104.29 109.79 28.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.222 -0.444 . . . . 64.21 111.127 179.913 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.739 HG22 ' CG2' ' A' ' 62' ' ' THR . 20.1 p -95.47 -176.88 3.9 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.173 -0.467 . . . . 43.31 111.144 179.964 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.46 HG22 ' CD1' ' A' ' 52' ' ' ILE . 69.5 p -66.11 -27.45 68.06 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.21 -0.45 . . . . 64.2 111.168 -179.99 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.07 -49.99 17.9 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.172 -0.467 . . . . 62.41 110.928 179.885 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.704 ' O ' HG23 ' A' ' 35' ' ' VAL . 23.8 mt-10 -70.61 -40.15 73.34 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.198 -0.455 . . . . 71.43 110.863 179.967 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.661 ' HB2' HG22 ' A' ' 27' ' ' ILE . 3.8 tt -74.31 -49.69 21.93 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.195 -0.457 . . . . 75.23 110.857 -179.914 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -54.63 -31.5 52.99 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.731 -0.747 . . . . 63.14 112.509 179.905 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 96.3 m -73.38 -47.04 45.33 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.814 0.34 . . . . 64.02 111.125 -179.856 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.704 HG23 ' O ' ' A' ' 31' ' ' GLU . 51.7 t -54.54 -54.34 23.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.229 -0.441 . . . . 75.24 111.151 179.892 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' MET . . . . . 0.524 ' HA ' HD12 ' A' ' 39' ' ' LEU . 8.2 ptm -65.72 -36.73 84.44 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.136 -0.484 . . . . 54.42 110.872 179.932 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 52.4 ttt85 -54.31 -37.31 64.68 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.244 -0.434 . . . . 53.5 110.921 -179.962 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' SER . . . . . 0.585 ' OG ' HD11 ' M' ' 41' ' ' LEU . 0.9 OUTLIER -70.04 -23.63 63.13 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.2 -0.455 . . . . 74.33 110.883 -179.816 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.956 HD13 ' HB3' ' M' ' 37' ' ' ALA . 18.3 mt -85.59 -10.72 55.45 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.121 -0.491 . . . . 73.55 110.919 179.978 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 101.78 22.49 10.14 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.772 -0.728 . . . . 73.03 112.482 179.871 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 3.8 mp0 -121.22 96.81 5.24 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.787 0.327 . . . . 74.14 110.935 -179.891 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 52.5 t30 -109.89 79.34 1.45 Allowed Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.63 0.729 . . . . 71.35 110.908 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.79 168.21 22.25 Favored 'Trans proline' 0 C--O 1.232 0.205 0 C-N-CA 122.685 2.256 . . . . 71.12 112.344 179.964 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 24.7 p -79.22 159.9 27.13 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.224 -0.444 . . . . 63.22 111.146 -179.969 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -51.66 -45.72 63.49 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.197 -0.456 . . . . 73.44 110.88 -179.958 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -68.42 -31.39 70.7 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.142 -0.481 . . . . 72.03 111.081 179.969 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 76.9 tt0 -69.7 -44.81 69.65 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.261 -0.427 . . . . 73.11 110.834 -179.922 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 27.3 mt -56.35 -51.88 66.65 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.165 -0.471 . . . . 70.41 110.913 -179.958 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 24.2 tp60 -66.1 -28.03 68.51 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.183 -0.462 . . . . 75.14 110.879 179.958 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 23.4 t0 -56.26 -49.66 73.57 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.183 -0.462 . . . . 60.23 110.845 -179.977 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' MET . . . . . 0.42 ' HE2' ' HB3' ' M' ' 31' ' ' LEU . 8.0 ptp -74.07 -36.91 64.36 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.216 -0.447 . . . . 72.13 110.934 179.953 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.46 ' CD1' HG22 ' A' ' 29' ' ' THR . 91.1 mt -62.55 -38.27 81.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.218 -0.446 . . . . 71.02 111.128 179.966 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 15.1 m-20 -66.61 -24.66 66.35 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.181 -0.463 . . . . 73.33 110.891 179.952 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -76.22 -26.53 56.18 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.129 -0.487 . . . . 71.41 110.875 179.978 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.538 HG13 ' CE1' ' M' ' 29' ' ' TYR . 4.4 m -108.41 8.39 9.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.202 -0.454 . . . . 64.25 111.161 179.956 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 30.8 t0 -82.99 98.39 9.23 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.15 -0.477 . . . . 74.41 110.84 179.936 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.28 -43.02 11.87 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.203 -0.453 . . . . 51.44 111.067 179.961 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 43.5 p30 -84.26 -0.12 51.08 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.191 -0.459 . . . . 70.21 110.882 179.974 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 54.84 54.8 31.13 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.756 -0.735 . . . . 53.31 112.497 -179.933 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 49.7 p-10 -114.56 -15.67 11.97 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.875 0.369 . . . . 75.23 110.893 -179.869 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 94.16 18.56 36.21 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.744 -0.741 . . . . 53.13 112.527 179.994 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' THR . . . . . 0.739 ' CG2' HG22 ' A' ' 28' ' ' THR . 20.4 p -145.62 175.52 10.3 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.776 0.322 . . . . 73.4 111.082 -179.844 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.447 HG21 ' HD1' ' A' ' 68' ' ' PHE . 18.9 mt -108.75 110.6 32.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.194 -0.457 . . . . 73.45 111.132 179.922 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.0 t0 -76.02 -172.93 2.15 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.199 -0.455 . . . . 64.23 110.862 179.9 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.521 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 2.4 t80 -64.76 -58.19 13.96 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-O 121.675 0.75 . . . . 61.33 110.893 -179.878 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 66' ' ' PRO . . . . . 0.521 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 54.0 Cg_endo -69.72 -26.8 27.41 Favored 'Trans proline' 0 C--N 1.342 0.208 0 C-N-CA 122.696 2.264 . . . . 65.31 112.331 179.972 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 63.0 mt-10 -61.59 -40.46 94.85 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.232 -0.44 . . . . 71.15 110.918 -179.976 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' PHE . . . . . 0.447 ' HD1' HG21 ' A' ' 63' ' ' ILE . 25.1 t80 -74.44 -35.83 63.37 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.163 -0.471 . . . . 53.43 110.86 -179.93 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.591 HD13 ' CB ' ' A' ' 12' ' ' PHE . 35.3 tp -69.61 -54.06 15.79 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.107 -0.497 . . . . 53.33 110.914 -179.94 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 14.6 t -52.82 -30.38 33.07 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.182 -0.463 . . . . 62.12 111.151 179.966 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' MET . . . . . 0.481 ' HE1' HD11 ' M' ' 31' ' ' LEU . 39.2 ttp -60.4 -51.23 70.36 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.197 -0.456 . . . . 71.44 110.88 179.91 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 5.2 mmt -70.24 -46.03 65.28 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.244 -0.434 . . . . 71.11 110.906 179.956 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -54.62 -32.54 59.08 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.228 -0.442 . . . . 73.34 111.093 179.912 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 24.3 ttm180 -60.46 -25.8 66.28 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.219 -0.446 . . . . 73.21 110.873 -179.897 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 2.7 tmtm? -58.38 -28.33 65.06 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.188 -0.46 . . . . 73.12 110.864 179.985 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' MET . . . . . 0.487 ' SD ' HD21 ' A' ' 4' ' ' LEU . 38.7 mtm -53.28 -41.56 65.69 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.208 -0.451 . . . . 65.2 110.889 179.829 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -157.11 139.15 14.44 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.239 -0.437 . . . . 71.4 110.88 179.982 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 -173.81 -177.62 1.42 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.235 -0.439 . . . . 75.1 110.873 179.848 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 1.9 t -152.36 74.53 1.08 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.198 -0.456 . . . . 62.14 111.094 -179.867 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -112.7 -26.37 8.64 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.251 -0.431 . . . . 53.34 110.889 179.896 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 1.7 p -52.19 -52.55 51.45 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.167 -0.47 . . . . 74.21 110.846 -179.741 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -72.87 -27.21 61.77 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.11 -0.495 . . . . 71.33 110.919 -179.96 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 18.3 tt0 -66.18 -36.15 82.34 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.097 -0.502 . . . . 70.14 110.896 -179.929 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -62.08 -36.36 81.45 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.167 -0.469 . . . . 73.04 110.874 -179.935 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.609 HD13 HG13 ' A' ' 142' ' ' VAL . 68.8 mt -75.1 -50.98 22.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.123 -0.489 . . . . 72.45 111.104 -179.975 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 34.9 ttm180 -63.41 -28.23 69.84 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.2 -0.455 . . . . 73.25 110.855 179.957 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.719 ' O ' HG23 ' A' ' 91' ' ' VAL . 2.3 mm-40 -63.8 -50.91 67.12 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.245 -0.434 . . . . 62.23 110.84 -179.889 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -66.13 -44.02 85.41 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.195 -0.457 . . . . 75.02 111.1 179.962 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 5.7 t80 -51.97 -48.02 64.55 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.184 -0.462 . . . . 64.01 110.863 -179.921 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 4.3 ttt-85 -63.78 -39.9 95.38 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.157 -0.474 . . . . 72.44 110.864 -179.911 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 91' ' ' VAL . . . . . 0.719 HG23 ' O ' ' A' ' 87' ' ' GLU . 90.4 t -59.37 -33.53 51.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.213 -0.448 . . . . 72.13 111.142 179.982 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.551 ' CE1' HG11 ' A' ' 108' ' ' VAL . 8.6 m-85 -89.98 -26.19 20.49 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.191 -0.458 . . . . 63.31 110.89 -179.986 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 17.1 t0 -73.97 95.6 2.52 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.16 -0.473 . . . . 60.12 110.834 -179.999 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 13.5 mtpt -78.67 -53.25 7.35 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.224 -0.444 . . . . 74.41 110.922 179.963 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 48.9 p30 -73.55 -9.15 58.38 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.239 -0.437 . . . . 73.31 110.909 179.841 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 60.35 31.54 74.26 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.724 -0.75 . . . . 64.54 112.494 -179.92 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 45.6 p-10 -86.24 -16.2 38.42 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.856 0.36 . . . . 75.21 110.879 -179.891 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 89.91 18.73 49.98 Favored Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.69 -0.767 . . . . 62.35 112.492 -179.975 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 14.1 m-85 -134.58 155.68 50.02 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.921 0.391 . . . . 73.12 110.912 -179.839 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 68.5 mt -122.77 121.44 63.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.136 -0.484 . . . . 72.11 111.11 179.957 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 59.7 p -114.59 176.53 5.01 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.172 -0.467 . . . . 70.35 110.872 -179.899 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 102' ' ' ALA . . . . . 0.532 ' HB1' ' CG1' ' A' ' 121' ' ' VAL . . . -66.08 -24.95 66.81 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.133 -0.485 . . . . 71.51 111.113 179.909 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -71.81 -49.91 34.39 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.164 -0.471 . . . . 44.44 111.108 179.949 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -76.63 -47.77 21.21 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.213 -0.449 . . . . 74.34 110.855 -179.877 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.858 HD21 ' HE2' ' A' ' 124' ' ' MET . 23.5 tp -52.95 -50.75 63.43 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.183 -0.462 . . . . 64.44 110.909 -179.974 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 106' ' ' ARG . . . . . 0.484 ' O ' HG23 ' A' ' 110' ' ' THR . 64.2 ttt-85 -52.32 -37.81 56.91 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.199 -0.455 . . . . 73.34 110.897 179.942 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 43.6 t60 -58.93 -34.4 71.7 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.14 -0.482 . . . . 72.24 110.873 179.982 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.551 HG11 ' CE1' ' A' ' 92' ' ' PHE . 21.7 t -74.47 -49.12 32.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.217 -0.447 . . . . 71.01 111.123 179.955 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 109' ' ' MET . . . . . 0.758 ' HA ' HD12 ' A' ' 112' ' ' LEU . 3.9 mmt -64.91 -27.16 68.66 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.185 -0.461 . . . . 74.42 110.894 179.921 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 110' ' ' THR . . . . . 0.484 HG23 ' O ' ' A' ' 106' ' ' ARG . 18.9 p -75.32 -48.3 23.77 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.238 -0.437 . . . . 71.43 111.164 -179.944 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 12.2 t30 -56.61 -26.62 56.13 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.241 -0.436 . . . . 75.31 110.889 179.967 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.758 HD12 ' HA ' ' A' ' 109' ' ' MET . 6.6 mt -70.72 -22.52 62.43 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.184 -0.462 . . . . 72.54 110.92 179.958 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 101.09 33.09 5.06 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.771 -0.728 . . . . 50.15 112.444 179.882 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 24.7 mm-40 -122.28 109.97 15.11 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.899 0.38 . . . . 74.22 110.871 -179.89 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 115' ' ' LYS . . . . . 0.512 ' O ' HD23 ' A' ' 116' ' ' LEU . 28.0 tptt -65.44 137.1 57.23 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.188 -0.46 . . . . 72.43 110.874 179.99 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.583 HD22 ' HG2' ' A' ' 120' ' ' GLU . 48.2 mt -145.76 150.71 36.73 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.209 -0.45 . . . . 65.02 110.914 179.929 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 117' ' ' THR . . . . . 0.714 ' O ' HG23 ' A' ' 121' ' ' VAL . 73.2 p -100.49 170.05 8.65 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.219 -0.446 . . . . 74.14 111.145 179.96 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -53.06 -44.61 67.6 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.25 -0.432 . . . . 74.32 110.845 179.891 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 -70.38 -45.44 66.04 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.239 -0.437 . . . . 74.21 110.884 -179.891 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 120' ' ' GLU . . . . . 0.583 ' HG2' HD22 ' A' ' 116' ' ' LEU . 5.7 tp10 -55.08 -32.18 61.77 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.185 -0.461 . . . . 64.51 110.898 -179.948 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.714 HG23 ' O ' ' A' ' 117' ' ' THR . 73.9 t -69.59 -30.85 46.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.206 -0.452 . . . . 71.44 111.143 179.964 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -78.49 -28.52 46.36 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.12 -0.491 . . . . 72.14 110.878 179.9 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -55.74 -50.01 71.55 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.172 -0.467 . . . . 54.02 110.876 -179.867 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 124' ' ' MET . . . . . 0.858 ' HE2' HD21 ' A' ' 105' ' ' LEU . 12.4 ptm -66.72 -44.31 81.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.167 -0.47 . . . . 71.42 110.929 179.911 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 28.4 mm -53.94 -35.43 28.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.216 -0.447 . . . . 63.0 111.153 179.956 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 23.0 ttp180 -66.8 -31.78 72.63 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.16 -0.473 . . . . 73.14 110.844 179.95 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 10.1 tm-20 -68.83 -40.0 79.68 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.187 -0.461 . . . . 75.42 110.857 -179.928 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.657 ' HB3' HG22 ' A' ' 136' ' ' VAL . . . -82.57 -29.6 30.17 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.178 -0.464 . . . . 63.2 111.105 179.951 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 43.3 t0 -68.39 86.91 0.29 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.23 -0.441 . . . . 73.23 110.915 179.949 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 81.3 mt -79.69 -48.42 20.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.173 -0.467 . . . . 55.33 111.16 -179.955 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 18.7 p30 -73.01 -8.6 56.45 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.157 -0.474 . . . . 72.12 110.835 179.846 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 63.49 43.05 98.72 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.739 -0.743 . . . . 43.24 112.517 -179.915 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 25.8 p-10 -89.53 -15.8 32.13 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.868 0.366 . . . . 65.33 110.856 -179.909 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 102.96 3.51 48.73 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.723 -0.751 . . . . 70.2 112.484 179.993 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -149.14 172.11 15.34 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.852 0.358 . . . . 72.34 110.905 -179.84 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 136' ' ' VAL . . . . . 0.657 HG22 ' HB3' ' A' ' 128' ' ' ALA . 82.7 t -107.67 109.18 27.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.211 -0.45 . . . . 61.31 111.149 179.937 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 20.8 p30 -92.04 164.76 13.49 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.183 -0.462 . . . . 74.02 110.888 -179.978 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 138' ' ' TYR . . . . . 0.614 ' O ' HG23 ' A' ' 142' ' ' VAL . 15.5 t80 -52.3 -45.73 65.66 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.172 -0.467 . . . . 73.44 110.909 -179.868 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -52.01 -40.07 60.42 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.155 -0.475 . . . . 75.24 110.864 -179.986 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 24.2 mt-10 -78.42 -48.47 15.38 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.223 -0.444 . . . . 70.11 110.856 -179.928 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 47.6 t80 -54.17 -40.55 67.59 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.123 -0.489 . . . . 74.14 110.878 -179.916 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 142' ' ' VAL . . . . . 0.614 HG23 ' O ' ' A' ' 138' ' ' TYR . 92.6 t -69.23 -38.77 78.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.138 -0.483 . . . . 73.52 111.145 179.981 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 50.8 tt0 -68.66 -41.23 79.63 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.153 -0.476 . . . . 73.42 110.943 -179.992 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -74.73 -51.81 13.24 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.198 -0.455 . . . . 63.12 110.857 179.979 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 32.9 tpp -51.92 -30.11 22.95 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.209 -0.451 . . . . 54.22 110.929 179.901 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 89.6 m -92.58 -27.56 17.28 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.236 -0.438 . . . . 65.25 111.133 -179.95 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -56.3 140.65 44.31 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.251 -0.431 . . . . 34.13 111.102 179.839 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 11.0 tptm . . . . . 0 C--N 1.328 -0.34 0 CA-C-N 116.21 -0.45 . . . . 75.35 110.874 179.993 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' M' M ' 8' ' ' LEU . . . . . . . . . . . . . 11.4 mt . . . . . 0 C--O 1.231 0.086 0 CA-C-O 120.867 0.365 . . . . 63.2 110.946 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' M' M ' 9' ' ' SER . . . . . . . . . . . . . 10.3 t -133.01 174.57 10.22 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.172 -0.467 . . . . 73.04 110.869 -179.93 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' M' M ' 10' ' ' GLY . . . . . . . . . . . . . . . -155.94 -108.18 0.28 Allowed Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.718 -0.754 . . . . 33.35 112.457 -179.96 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' M' M ' 11' ' ' GLY . . . . . . . . . . . . . . . 111.89 -129.69 9.24 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.734 -0.746 . . . . 72.11 112.498 -179.897 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' M' M ' 12' ' ' GLU . . . . . . . . . . . . . 16.8 mm-40 -64.18 -169.96 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.882 0.372 . . . . 55.54 110.865 -179.895 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' M' M ' 13' ' ' LEU . . . . . 0.402 HD22 ' HA ' ' M' ' 13' ' ' LEU . 1.0 OUTLIER -76.23 77.52 3.03 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.133 -0.485 . . . . 70.01 110.912 179.97 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' M' M ' 14' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -98.98 15.43 25.77 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.18 -0.464 . . . . 72.35 110.865 179.829 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' M' M ' 15' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.99 -42.05 70.16 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.204 -0.453 . . . . 73.3 110.873 -179.993 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' M' M ' 16' ' ' TRP . . . . . 0.401 ' CZ3' HD12 ' M' ' 19' ' ' ILE . 32.2 m95 -56.59 -28.13 59.61 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.228 -0.442 . . . . 74.22 110.887 179.947 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' M' M ' 17' ' ' GLU . . . . . . . . . . . . . 9.5 tt0 -54.04 -30.26 47.1 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.267 -0.424 . . . . 73.43 110.916 -179.992 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' M' M ' 18' ' ' LYS . . . . . 0.564 ' CD ' HD13 ' A' ' 112' ' ' LEU . 2.3 ttmp? -60.77 -25.96 66.89 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.132 -0.485 . . . . 62.43 110.878 179.969 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' M' M ' 19' ' ' ILE . . . . . 0.401 HD12 ' CZ3' ' M' ' 16' ' ' TRP . 29.4 mt -103.5 -42.06 7.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.245 -0.434 . . . . 74.35 111.161 179.866 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' M' M ' 20' ' ' ARG . . . . . . . . . . . . . 46.0 ttp180 -66.69 -22.23 66.08 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.174 -0.466 . . . . 65.45 110.839 -179.969 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' M' M ' 21' ' ' LEU . . . . . . . . . . . . . 5.9 mt 63.42 160.64 0.09 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.167 -0.47 . . . . 61.21 110.935 -179.945 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' M' M ' 22' ' ' ARG . . . . . . . . . . . . . 50.8 ttm-85 -78.57 136.83 59.34 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.614 0.721 . . . . 74.15 110.853 179.96 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' M' M ' 23' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.83 93.15 0.52 Allowed 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.69 2.26 . . . . 72.44 112.295 -179.98 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' M' M ' 24' ' ' GLY . . . . . . . . . . . . . . . -148.48 52.5 0.54 Allowed Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.71 -0.757 . . . . 73.21 112.458 179.948 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' M' M ' 25' ' ' GLY . . . . . . . . . . . . . . . 169.5 84.77 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.746 -0.74 . . . . 71.21 112.462 -179.938 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' M' M ' 26' ' ' LYS . . . . . . . . . . . . . 25.5 mtpp -97.86 29.97 3.2 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.819 0.342 . . . . 73.24 110.889 -179.98 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' M' M ' 27' ' ' LYS . . . . . . . . . . . . . 8.0 tttm -148.88 145.19 27.34 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.232 -0.44 . . . . 73.33 110.868 179.888 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' M' M ' 28' ' ' GLN . . . . . . . . . . . . . 7.9 pt20 -56.87 163.75 1.83 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.181 -0.463 . . . . 71.43 110.927 179.943 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' M' M ' 29' ' ' TYR . . . . . 0.538 ' CE1' HG13 ' A' ' 55' ' ' VAL . 47.0 m-85 57.56 179.1 0.05 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.191 -0.459 . . . . 73.12 110.938 -179.878 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' M' M ' 30' ' ' LYS . . . . . . . . . . . . . 5.4 ttmm -144.24 15.05 1.66 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.153 -0.476 . . . . 53.44 110.903 179.885 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' M' M ' 31' ' ' LEU . . . . . 0.481 HD11 ' HE1' ' A' ' 71' ' ' MET . 0.8 OUTLIER -118.52 -28.93 5.58 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.195 -0.457 . . . . 64.41 110.908 179.918 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' M' M ' 32' ' ' LYS . . . . . . . . . . . . . 1.8 mttp -48.9 -44.44 40.16 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.184 -0.462 . . . . 45.23 110.875 179.823 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' M' M ' 33' ' ' HIS . . . . . . . . . . . . . 56.5 t-80 -50.26 -39.78 46.05 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.212 -0.449 . . . . 71.22 110.908 179.903 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' M' M ' 34' ' ' ILE . . . . . . . . . . . . . 29.2 mt -50.31 -39.86 17.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.182 -0.463 . . . . 72.2 111.137 179.974 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' M' M ' 35' ' ' VAL . . . . . . . . . . . . . 61.2 t -48.81 -40.71 12.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.204 -0.453 . . . . 55.3 111.096 179.844 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' M' M ' 36' ' ' TRP . . . . . . . . . . . . . 21.4 m0 -59.2 -39.74 83.57 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.214 -0.448 . . . . 74.3 110.916 -179.995 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' M' M ' 37' ' ' ALA . . . . . 0.956 ' HB3' HD13 ' A' ' 39' ' ' LEU . . . -63.21 -18.7 63.8 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.226 -0.443 . . . . 73.42 111.089 179.858 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' M' M ' 38' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -66.29 -18.03 65.11 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.259 -0.428 . . . . 75.21 110.857 -179.792 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' M' M ' 39' ' ' ARG . . . . . . . . . . . . . 12.5 ptt180 -55.62 -25.74 40.45 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.109 -0.496 . . . . 74.35 110.866 -179.946 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' M' M ' 40' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -91.3 -47.97 7.18 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.203 -0.453 . . . . 65.41 110.894 -179.931 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' M' M ' 41' ' ' LEU . . . . . 0.585 HD11 ' OG ' ' A' ' 38' ' ' SER . 10.8 mt -67.41 130.42 43.01 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.182 -0.463 . . . . 71.05 110.88 -179.97 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' M' M ' 42' ' ' GLU . . . . . . . . . . . . . 22.9 tp10 -93.72 -28.46 15.94 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.228 -0.442 . . . . 73.45 110.887 179.921 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' M' M ' 43' ' ' ARG . . . . . . . . . . . . . 10.2 mpt_? . . . . . 0 C--N 1.329 -0.293 0 CA-C-N 116.111 -0.495 . . . . 73.54 110.87 -179.899 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 241' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 262' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 301' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 322' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.131 0 CA-C-O 120.761 0.315 . . . . 72.14 111.079 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 12.2 t0 56.59 29.62 15.89 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.237 -0.438 . . . . 75.41 110.858 -179.986 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 46.8 tt0 -144.99 142.74 30.06 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.188 -0.46 . . . . 73.21 110.928 -179.943 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.473 HD22 ' NE2' ' A' ' 8' ' ' GLN . 9.3 mt -82.29 136.85 34.97 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.174 -0.466 . . . . 70.25 110.893 -179.97 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.726 ' O ' HD12 ' A' ' 9' ' ' ILE . 1.4 p -89.38 170.19 10.75 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.176 -0.466 . . . . 74.4 111.141 179.982 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 6.6 tm-20 -53.31 -41.31 65.55 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.233 -0.44 . . . . 73.21 110.876 -179.994 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -63.55 -26.7 68.82 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.143 -0.48 . . . . 72.21 110.899 -179.922 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' GLN . . . . . 0.473 ' NE2' HD22 ' A' ' 4' ' ' LEU . 13.8 tt0 -76.9 -54.54 6.45 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.151 -0.477 . . . . 75.4 110.896 -179.939 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' ILE . . . . . 0.726 HD12 ' O ' ' A' ' 5' ' ' THR . 3.3 mp -65.96 -50.35 70.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.232 -0.44 . . . . 74.23 111.133 179.973 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -56.02 -25.47 44.68 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.189 -0.46 . . . . 71.45 111.12 179.812 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 14.2 tp10 -75.17 -38.39 60.91 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.206 -0.452 . . . . 72.14 110.856 -179.948 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.45 ' CB ' HD13 ' A' ' 69' ' ' LEU . 54.2 m-85 -76.28 -46.13 29.32 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.175 -0.466 . . . . 73.42 110.911 -179.908 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 7.8 ptmm? -57.25 -29.39 63.77 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.183 -0.462 . . . . 70.41 110.919 179.945 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -66.82 -37.54 84.72 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.194 -0.457 . . . . 74.04 110.889 179.939 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -67.03 -37.17 83.64 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.159 -0.473 . . . . 71.41 111.089 179.934 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 77.4 t80 -59.45 -54.31 48.14 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.227 -0.442 . . . . 64.54 110.878 -179.895 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 41.5 t -56.3 -28.13 57.77 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.118 -0.492 . . . . 71.33 110.833 -179.767 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 15.5 tp -65.5 -40.79 93.47 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.138 -0.483 . . . . 73.43 110.894 -179.985 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.55 ' HA ' HG21 ' A' ' 35' ' ' VAL . 43.1 m-85 -80.49 -24.67 39.26 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.2 -0.454 . . . . 61.21 110.858 179.973 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 9.8 t0 -79.44 98.61 6.85 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.165 -0.471 . . . . 75.0 110.849 179.998 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.68 -47.06 82.74 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.193 -0.458 . . . . 64.5 110.816 -179.966 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 24.4 p-10 -86.89 -10.21 53.89 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.246 -0.434 . . . . 72.25 110.905 179.894 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 51.41 46.23 52.63 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.728 -0.749 . . . . 75.0 112.49 -179.953 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 29.5 p-10 -88.73 -14.06 38.13 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.843 0.354 . . . . 72.55 110.89 -179.984 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 105.35 13.41 24.66 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.788 -0.72 . . . . 53.54 112.491 -179.95 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 1.4 p -154.65 142.26 19.82 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.772 0.32 . . . . 54.14 111.108 -179.872 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 25.1 mt -101.84 124.99 56.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.209 -0.45 . . . . 75.1 111.102 179.943 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.552 HG22 ' CG2' ' A' ' 62' ' ' THR . 39.5 p -110.05 174.83 5.68 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.188 -0.46 . . . . 71.24 111.141 179.929 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.737 HG22 HD12 ' A' ' 52' ' ' ILE . 61.0 p -61.07 -31.89 71.54 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.178 -0.464 . . . . 72.5 111.134 179.993 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.84 -49.93 12.11 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.224 -0.444 . . . . 71.1 110.906 179.937 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 23.3 mt-10 -61.26 -33.62 73.84 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.211 -0.45 . . . . 63.54 110.908 179.958 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.1 tt -74.24 -55.11 6.43 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.12 -0.491 . . . . 71.24 110.926 -179.994 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -52.22 -27.87 24.98 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.747 -0.74 . . . . 73.42 112.461 179.948 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 54.8 m -63.69 -59.18 4.92 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.797 0.332 . . . . 73.22 111.12 -179.861 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.55 HG21 ' HA ' ' A' ' 19' ' ' PHE . 36.3 t -52.62 -49.29 45.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.208 -0.451 . . . . 73.21 111.09 179.957 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 28.2 mtp -51.83 -35.79 45.75 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.186 -0.461 . . . . 55.43 110.907 179.904 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 24.5 ttp180 -55.73 -51.88 65.84 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.199 -0.455 . . . . 74.12 110.891 -179.942 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' SER . . . . . 0.636 ' OG ' HD21 ' M' ' 41' ' ' LEU . 3.8 t -66.45 -28.5 68.65 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.179 -0.464 . . . . 75.12 110.87 -179.816 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.963 HD13 ' HB3' ' M' ' 37' ' ' ALA . 57.6 mt -77.14 -24.3 51.62 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.111 -0.495 . . . . 72.4 110.924 179.963 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 101.35 32.8 5.08 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.756 -0.735 . . . . 54.02 112.477 179.89 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 17.6 mm-40 -131.09 105.42 7.7 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.853 0.358 . . . . 65.01 110.897 -179.874 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 59.9 t30 -109.86 76.93 1.01 Allowed Pre-proline 0 C--N 1.33 -0.282 0 CA-C-O 121.619 0.723 . . . . 71.44 110.878 -179.948 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.83 168.01 22.88 Favored 'Trans proline' 0 C--O 1.231 0.162 0 C-N-CA 122.67 2.247 . . . . 62.32 112.315 179.965 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 76.7 p -86.95 157.53 19.47 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.209 -0.45 . . . . 72.43 111.14 -179.958 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -52.28 -39.22 60.17 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.233 -0.44 . . . . 74.34 110.88 179.984 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -72.13 -32.96 67.41 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.203 -0.453 . . . . 64.22 111.092 179.946 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 10.1 tt0 -69.7 -49.71 50.79 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.191 -0.458 . . . . 75.22 110.886 -179.916 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 34.1 mt -55.14 -43.08 73.84 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.163 -0.471 . . . . 50.53 110.885 -179.955 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -56.42 -33.63 66.01 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.151 -0.477 . . . . 64.34 110.895 179.951 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -70.18 -37.52 75.16 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.233 -0.439 . . . . 72.3 110.863 179.988 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 39.6 mtp -65.22 -57.84 7.49 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.204 -0.453 . . . . 72.33 110.88 -179.994 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.737 HD12 HG22 ' A' ' 29' ' ' THR . 62.4 mt -57.61 -42.64 81.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.21 -0.45 . . . . 55.24 111.167 179.96 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 48.6 m-20 -59.28 -37.19 77.03 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.146 -0.479 . . . . 72.41 110.842 179.936 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -65.69 -29.87 70.48 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.209 -0.451 . . . . 73.23 110.88 -179.993 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 14.7 m -103.15 6.64 10.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.144 -0.48 . . . . 75.4 111.142 179.979 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 31.3 t0 -90.11 96.63 10.76 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.125 -0.489 . . . . 74.04 110.869 179.927 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.18 -42.0 12.61 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.184 -0.462 . . . . 70.03 111.118 179.956 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -85.02 0.01 52.9 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.234 -0.439 . . . . 43.3 110.849 179.99 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 55.03 57.98 15.81 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.754 -0.736 . . . . 74.34 112.519 -179.924 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 52.2 p-10 -114.6 -15.7 11.95 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.871 0.367 . . . . 72.44 110.92 -179.917 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 90.06 16.91 55.18 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.738 -0.744 . . . . 63.13 112.446 179.917 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' THR . . . . . 0.552 ' CG2' HG22 ' A' ' 28' ' ' THR . 46.9 p -151.35 162.85 40.2 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.735 0.302 . . . . 73.1 111.158 -179.846 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 19.9 mt -96.94 116.99 40.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.184 -0.462 . . . . 74.14 111.124 179.921 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.4 t0 -81.12 -172.95 4.02 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.199 -0.455 . . . . 74.0 110.864 179.865 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.519 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 2.5 t80 -64.93 -58.4 12.96 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.64 0.733 . . . . 74.54 110.92 -179.932 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 66' ' ' PRO . . . . . 0.519 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 54.1 Cg_endo -69.76 -28.73 24.89 Favored 'Trans proline' 0 C--N 1.341 0.158 0 C-N-CA 122.681 2.254 . . . . 72.32 112.379 179.937 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 23.8 mt-10 -58.24 -45.45 87.73 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.218 -0.447 . . . . 63.34 110.88 179.992 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 13.2 t80 -71.37 -36.43 71.44 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.149 -0.478 . . . . 72.44 110.892 -179.948 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.45 HD13 ' CB ' ' A' ' 12' ' ' PHE . 15.3 tp -64.09 -53.7 45.63 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.169 -0.469 . . . . 74.04 110.922 -179.972 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 14.8 t -61.26 -29.46 69.86 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.189 -0.46 . . . . 75.22 111.153 179.94 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 5.6 tmm? -63.31 -43.83 96.72 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.223 -0.444 . . . . 74.53 110.885 179.902 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -79.49 -30.01 41.85 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.223 -0.444 . . . . 73.31 110.864 179.984 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -74.88 -28.5 60.67 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.238 -0.437 . . . . 71.35 111.09 179.924 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 44.2 ttm-85 -66.25 -19.09 65.72 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.216 -0.447 . . . . 73.24 110.902 -179.909 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 18.5 pttm -51.44 -30.79 20.72 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.176 -0.466 . . . . 72.01 110.888 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 14.8 ttt -52.36 -31.21 32.55 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.198 -0.455 . . . . 62.12 110.86 179.906 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 25.5 mtpp -153.11 121.14 6.13 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.277 -0.42 . . . . 74.43 110.919 179.94 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -158.95 176.73 11.95 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.241 -0.436 . . . . 74.51 110.838 179.87 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 6.6 p -52.13 158.64 1.07 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.147 -0.479 . . . . 45.44 111.175 -179.907 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 14.2 p-10 -138.16 -44.22 0.51 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.247 -0.433 . . . . 73.25 110.871 179.927 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 71.0 m -58.37 -51.59 69.18 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.178 -0.465 . . . . 74.02 110.808 -179.731 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 27.9 tt0 -52.62 -57.97 8.3 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.152 -0.476 . . . . 70.52 110.912 -179.922 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -56.41 -42.32 77.8 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.172 -0.467 . . . . 72.43 110.913 179.983 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -54.73 -35.48 63.75 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.148 -0.478 . . . . 62.34 110.854 -179.908 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.94 HG21 HG22 ' A' ' 142' ' ' VAL . 49.8 mt -74.77 -36.39 39.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.175 -0.466 . . . . 74.55 111.135 179.994 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 2.2 tpm_? -70.78 -53.58 14.91 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.15 -0.477 . . . . 74.41 110.855 179.974 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.722 ' O ' HG23 ' A' ' 91' ' ' VAL . 1.6 pp20? -60.44 -39.87 89.06 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.18 -0.463 . . . . 65.45 110.894 -179.933 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -59.58 -48.51 81.39 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.148 -0.478 . . . . 51.23 111.086 179.946 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 9.1 t80 -52.08 -44.93 64.59 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.27 -0.423 . . . . 74.24 110.841 -179.87 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 6.5 tpt180 -66.38 -40.77 89.9 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.178 -0.464 . . . . 73.15 110.858 -179.91 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 91' ' ' VAL . . . . . 0.722 HG23 ' O ' ' A' ' 87' ' ' GLU . 92.4 t -58.4 -33.85 48.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.202 -0.454 . . . . 71.42 111.153 179.981 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 9.9 m-85 -87.52 -36.86 17.37 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.161 -0.472 . . . . 72.15 110.874 -180.0 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 17.6 t0 -61.3 96.05 0.05 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.151 -0.477 . . . . 64.24 110.847 -179.979 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 7.2 mtmp? -78.63 -52.55 8.28 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.16 -0.473 . . . . 74.21 110.924 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 32.7 p30 -75.45 -9.14 58.31 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.253 -0.431 . . . . 73.51 110.872 179.855 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 60.61 31.9 76.55 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.758 -0.734 . . . . 64.21 112.46 -179.972 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 48.6 p-10 -83.13 -16.1 48.09 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.879 0.371 . . . . 73.52 110.909 -179.931 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 86.72 18.7 57.9 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.77 -0.728 . . . . 73.51 112.489 179.99 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 6.4 m-85 -137.52 147.89 45.56 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.851 0.358 . . . . 64.11 110.942 -179.853 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 62.3 mt -112.7 112.9 42.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.117 -0.492 . . . . 74.13 111.111 179.919 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 52.0 p -107.05 -174.23 2.48 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.139 -0.482 . . . . 72.05 110.847 -179.915 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 102' ' ' ALA . . . . . 0.539 ' HB1' ' CG1' ' A' ' 121' ' ' VAL . . . -67.71 -32.25 72.76 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.112 -0.495 . . . . 71.21 111.086 179.927 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -69.88 -45.33 67.91 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.18 -0.464 . . . . 72.13 111.098 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 18.4 mt-10 -75.32 -51.24 13.66 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.197 -0.456 . . . . 72.03 110.89 -179.942 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 47.2 tp -53.48 -43.28 68.05 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.157 -0.474 . . . . 63.02 110.925 -179.982 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 56.1 ttp180 -56.21 -49.39 74.22 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.224 -0.444 . . . . 71.32 110.903 179.931 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 80.0 t60 -54.44 -34.92 62.36 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.21 -0.45 . . . . 75.52 110.841 -179.995 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 81.0 t -67.02 -46.2 85.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.201 -0.454 . . . . 75.0 111.16 179.93 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 109' ' ' MET . . . . . 0.403 ' HE1' ' HB2' ' M' ' 15' ' ' LYS . 3.3 mmt -69.47 -25.14 63.93 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.133 -0.485 . . . . 63.44 110.885 179.923 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 7.4 m -74.12 -56.26 5.13 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.185 -0.461 . . . . 71.1 111.132 -179.891 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 6.4 t-20 -56.75 -26.79 58.21 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.234 -0.439 . . . . 73.21 110.849 -179.984 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 19.3 mt -70.74 -22.25 62.44 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.178 -0.464 . . . . 73.34 110.914 179.987 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 101.09 33.02 5.08 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.757 -0.735 . . . . 71.42 112.467 179.859 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 24.7 tp10 -110.25 163.24 13.83 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.928 0.394 . . . . 73.12 110.901 -179.889 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 115' ' ' LYS . . . . . 0.493 ' O ' HD23 ' A' ' 116' ' ' LEU . 48.0 mttp -116.92 103.57 10.42 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.19 -0.459 . . . . 74.01 110.904 179.958 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.621 HD22 ' HG2' ' A' ' 120' ' ' GLU . 17.9 mt -131.25 113.22 13.55 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.183 -0.462 . . . . 73.31 110.9 179.932 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 34.3 p -72.04 172.72 9.56 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.169 -0.469 . . . . 73.44 111.133 179.951 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 69.1 m-20 -51.91 -38.14 55.13 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.184 -0.462 . . . . 73.44 110.895 179.908 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 50.4 tp10 -71.7 -35.99 70.41 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.189 -0.46 . . . . 74.14 110.891 -179.901 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 120' ' ' GLU . . . . . 0.621 ' HG2' HD22 ' A' ' 116' ' ' LEU . 2.0 tt0 -63.55 -40.0 95.87 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.153 -0.476 . . . . 74.31 110.872 -179.93 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.539 ' CG1' ' HB1' ' A' ' 102' ' ' ALA . 60.1 t -62.72 -43.68 98.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.179 -0.464 . . . . 72.33 111.107 -179.965 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 39.8 t0 -57.06 -55.13 38.7 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.19 -0.459 . . . . 64.15 110.851 179.906 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 10.9 tm-20 -56.25 -29.28 60.86 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.157 -0.474 . . . . 72.04 110.887 -179.893 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 124' ' ' MET . . . . . 0.462 ' HE1' HD11 ' M' ' 19' ' ' ILE . 24.6 ttt -68.01 -59.95 2.87 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.146 -0.479 . . . . 64.33 110.853 -179.965 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.501 HG23 HG23 ' A' ' 136' ' ' VAL . 31.4 mm -53.98 -35.78 29.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.235 -0.439 . . . . 72.42 111.092 179.98 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 31.6 ttp180 -61.12 -31.73 71.42 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.2 -0.454 . . . . 64.42 110.914 179.949 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 11.8 tm-20 -72.23 -46.27 56.76 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.185 -0.461 . . . . 75.35 110.881 -179.943 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.642 ' HB3' HG22 ' A' ' 136' ' ' VAL . . . -73.37 -25.52 60.62 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.173 -0.467 . . . . 70.52 111.101 179.938 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 38.8 t0 -68.07 87.34 0.27 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.205 -0.452 . . . . 73.13 110.878 179.975 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 70.5 mt -79.91 -48.12 20.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.195 -0.457 . . . . 62.2 111.151 179.988 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 18.9 p30 -75.1 -8.65 57.14 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.183 -0.462 . . . . 75.43 110.847 179.869 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 63.99 45.18 94.64 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.742 -0.742 . . . . 54.13 112.522 -179.884 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 35.3 p-10 -92.21 -15.84 27.01 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.867 0.365 . . . . 74.55 110.882 -179.977 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 103.46 2.83 47.36 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.772 -0.728 . . . . 33.21 112.522 -179.931 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -149.22 172.23 15.18 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.871 0.367 . . . . 75.23 110.952 -179.926 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 136' ' ' VAL . . . . . 0.642 HG22 ' HB3' ' A' ' 128' ' ' ALA . 49.1 t -108.49 113.25 43.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.21 -0.45 . . . . 45.55 111.132 179.98 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 16.3 p30 -93.17 172.1 8.52 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.159 -0.473 . . . . 75.04 110.924 179.997 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 88.6 t80 -54.91 -47.33 74.49 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.212 -0.449 . . . . 74.43 110.962 -179.922 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 25.1 tt0 -51.96 -49.72 62.63 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.094 -0.503 . . . . 74.34 110.886 -179.979 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 14.7 mt-10 -66.46 -32.68 74.2 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.18 -0.464 . . . . 70.34 110.825 -179.88 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 37.5 t80 -66.33 -45.32 80.64 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.177 -0.465 . . . . 64.33 110.926 -179.952 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 142' ' ' VAL . . . . . 0.94 HG22 HG21 ' A' ' 85' ' ' ILE . 66.8 t -69.53 -39.64 78.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.101 -0.499 . . . . 64.34 111.113 179.962 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 30.6 tt0 -62.28 -57.83 9.96 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.2 -0.455 . . . . 61.25 110.856 -179.964 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 11.6 tpt -56.57 -30.73 63.48 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.256 -0.429 . . . . 72.35 110.882 179.966 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 145' ' ' MET . . . . . 0.486 ' HE1' HG22 ' M' ' 19' ' ' ILE . 5.6 ttm -75.87 -37.22 59.13 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.219 -0.446 . . . . 64.44 110.935 179.934 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 1.9 m -97.54 21.19 10.59 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.16 -0.473 . . . . 55.24 111.158 -179.927 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -117.94 142.01 47.81 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.185 -0.462 . . . . 33.4 111.115 179.851 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 39.6 tttp . . . . . 0 C--N 1.329 -0.292 0 CA-C-N 116.205 -0.452 . . . . 72.34 110.94 179.964 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' M' M ' 8' ' ' LEU . . . . . . . . . . . . . 8.8 mp . . . . . 0 C--O 1.231 0.093 0 CA-C-O 120.853 0.358 . . . . 71.22 110.904 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' M' M ' 9' ' ' SER . . . . . . . . . . . . . 7.2 m 56.78 50.77 11.91 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.182 -0.463 . . . . 74.22 110.814 -179.923 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' M' M ' 10' ' ' GLY . . . . . . . . . . . . . . . 55.1 -153.54 11.58 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.756 -0.735 . . . . 74.23 112.444 179.97 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' M' M ' 11' ' ' GLY . . . . . . . . . . . . . . . -101.37 93.21 1.11 Allowed Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.709 -0.757 . . . . 70.21 112.453 -179.852 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' M' M ' 12' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -138.73 -171.57 3.11 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.896 0.379 . . . . 65.41 110.91 -179.911 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' M' M ' 13' ' ' LEU . . . . . 0.403 HD13 ' C ' ' M' ' 13' ' ' LEU . 2.1 tm? -72.27 83.51 1.04 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.178 -0.465 . . . . 74.21 110.934 -179.976 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' M' M ' 14' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -114.47 -15.91 11.99 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.209 -0.451 . . . . 74.11 110.853 179.889 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' M' M ' 15' ' ' LYS . . . . . 0.403 ' HB2' ' HE1' ' A' ' 109' ' ' MET . 0.2 OUTLIER -51.56 -46.62 63.49 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.185 -0.461 . . . . 73.41 110.914 179.989 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' M' M ' 16' ' ' TRP . . . . . 0.509 ' CZ2' ' HB2' ' A' ' 128' ' ' ALA . 6.1 m95 -58.1 -37.16 73.99 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.246 -0.434 . . . . 72.24 110.957 179.917 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' M' M ' 17' ' ' GLU . . . . . . . . . . . . . 11.9 tt0 -60.27 -22.06 62.64 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.24 -0.436 . . . . 74.05 110.911 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' M' M ' 18' ' ' LYS . . . . . . . . . . . . . 19.9 ttpp -65.31 -24.79 67.37 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.137 -0.483 . . . . 75.31 110.896 179.941 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' M' M ' 19' ' ' ILE . . . . . 0.486 HG22 ' HE1' ' A' ' 145' ' ' MET . 33.1 mt -97.09 -23.14 4.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.219 -0.446 . . . . 65.43 111.088 179.927 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' M' M ' 20' ' ' ARG . . . . . . . . . . . . . 37.1 ttp85 -52.62 -36.01 55.68 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.17 -0.468 . . . . 55.24 110.87 179.986 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' M' M ' 21' ' ' LEU . . . . . . . . . . . . . 3.9 mt 59.03 -174.02 0.1 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.216 -0.447 . . . . 73.01 110.903 -179.998 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' M' M ' 22' ' ' ARG . . . . . 0.488 ' CB ' ' CD ' ' M' ' 23' ' ' PRO . 0.3 OUTLIER -179.32 -61.86 0.0 OUTLIER Pre-proline 0 C--N 1.33 -0.276 0 CA-C-O 121.662 0.744 . . . . 73.34 110.902 179.941 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' M' M ' 23' ' ' PRO . . . . . 0.488 ' CD ' ' CB ' ' M' ' 22' ' ' ARG . 53.5 Cg_endo -69.79 91.99 0.52 Allowed 'Trans proline' 0 C--N 1.342 0.199 0 C-N-CA 122.675 2.25 . . . . 72.14 112.284 -179.982 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' M' M ' 24' ' ' GLY . . . . . . . . . . . . . . . -114.54 -135.11 5.89 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.704 -0.76 . . . . 64.05 112.476 179.939 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' M' M ' 25' ' ' GLY . . . . . . . . . . . . . . . 150.09 -19.35 1.08 Allowed Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.754 -0.736 . . . . 21.22 112.489 -179.881 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' M' M ' 26' ' ' LYS . . . . . . . . . . . . . 7.9 mtpp -56.18 175.96 0.09 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.901 0.381 . . . . 75.33 110.852 -179.986 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' M' M ' 27' ' ' LYS . . . . . . . . . . . . . 6.9 ptpt -177.22 142.38 0.35 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.183 -0.462 . . . . 64.3 110.925 179.846 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' M' M ' 28' ' ' GLN . . . . . . . . . . . . . 79.5 mm-40 -150.97 165.59 33.25 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.202 -0.454 . . . . 62.45 110.895 179.999 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' M' M ' 29' ' ' TYR . . . . . . . . . . . . . 2.1 t80 -118.48 -11.01 10.01 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.212 -0.449 . . . . 73.2 110.933 -179.894 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' M' M ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 63.68 26.26 14.5 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.113 -0.494 . . . . 74.25 110.878 179.938 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' M' M ' 31' ' ' LEU . . . . . . . . . . . . . 11.8 tp -157.59 -49.89 0.07 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.259 -0.428 . . . . 65.22 110.928 179.902 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' M' M ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.43 -35.89 41.41 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.21 -0.45 . . . . 73.13 110.882 179.826 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' M' M ' 33' ' ' HIS . . . . . . . . . . . . . 13.0 t-80 -50.86 -38.72 50.96 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.189 -0.46 . . . . 44.22 110.853 179.908 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' M' M ' 34' ' ' ILE . . . . . . . . . . . . . 49.5 mm -50.03 -38.7 14.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.243 -0.435 . . . . 74.45 111.153 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' M' M ' 35' ' ' VAL . . . . . . . . . . . . . 40.9 t -50.17 -40.17 17.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.182 -0.463 . . . . 74.03 111.142 179.854 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' M' M ' 36' ' ' TRP . . . . . . . . . . . . . 20.9 m0 -59.66 -36.57 76.68 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.19 -0.459 . . . . 61.42 110.893 179.977 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' M' M ' 37' ' ' ALA . . . . . 0.963 ' HB3' HD13 ' A' ' 39' ' ' LEU . . . -63.62 -18.83 64.33 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.239 -0.437 . . . . 74.2 111.076 179.901 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' M' M ' 38' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -73.67 -17.94 61.08 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.208 -0.451 . . . . 74.31 110.858 -179.754 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' M' M ' 39' ' ' ARG . . . . . . . . . . . . . 14.2 ttt180 -55.0 -26.58 37.92 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.1 -0.5 . . . . 64.23 110.888 -179.976 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' M' M ' 40' ' ' GLU . . . . . . . . . . . . . 3.5 pt-20 -84.58 -32.21 23.91 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.166 -0.47 . . . . 74.35 110.868 -179.896 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' M' M ' 41' ' ' LEU . . . . . 0.636 HD21 ' OG ' ' A' ' 38' ' ' SER . 11.2 mt -74.93 174.24 9.55 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.146 -0.479 . . . . 73.15 110.929 -179.985 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' M' M ' 42' ' ' GLU . . . . . . . . . . . . . 46.3 tt0 -172.16 77.98 0.05 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.231 -0.44 . . . . 75.13 110.882 179.975 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' M' M ' 43' ' ' ARG . . . . . . . . . . . . . 6.0 ptp85 . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 116.167 -0.469 . . . . 72.31 110.835 -179.887 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 241' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 262' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 301' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 322' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.09 0 CA-C-O 120.811 0.339 . . . . 72.04 111.079 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -111.44 -66.63 1.06 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.214 -0.448 . . . . 64.14 110.856 -179.993 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 25.3 pt20 -118.69 177.26 4.9 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.183 -0.462 . . . . 63.2 110.908 -179.911 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.507 HD13 ' CD ' ' A' ' 8' ' ' GLN . 3.9 mm? -114.95 109.33 17.96 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.195 -0.457 . . . . 71.31 110.925 179.981 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 77.7 p -102.39 176.3 5.23 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.198 -0.455 . . . . 73.44 111.137 179.971 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -57.27 -33.98 68.18 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.251 -0.431 . . . . 75.4 110.862 -179.959 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 84.7 tt0 -68.07 -38.3 82.25 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.175 -0.466 . . . . 62.42 110.894 -179.935 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' GLN . . . . . 0.507 ' CD ' HD13 ' A' ' 4' ' ' LEU . 47.8 tt0 -78.01 -37.37 47.26 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.159 -0.473 . . . . 72.31 110.922 -179.956 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 52.8 mt -72.9 -40.93 60.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.183 -0.462 . . . . 63.2 111.145 179.983 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.41 -28.15 69.58 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.124 -0.489 . . . . 73.15 111.144 179.756 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 19.5 mm-40 -74.93 -52.14 11.97 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.214 -0.448 . . . . 61.13 110.88 -179.909 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 26.3 m-85 -66.89 -45.99 76.28 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.156 -0.475 . . . . 73.12 110.88 -179.919 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -52.92 -46.17 67.95 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.143 -0.48 . . . . 72.5 110.931 179.948 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -54.93 -30.84 59.54 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.188 -0.46 . . . . 73.23 110.868 -179.997 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -69.52 -45.29 69.18 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.172 -0.467 . . . . 64.05 111.08 179.933 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 85.5 t80 -54.75 -54.26 44.31 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.191 -0.459 . . . . 75.33 110.903 -179.906 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 10.6 t -61.58 -26.38 67.93 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.15 -0.477 . . . . 61.12 110.902 -179.806 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 2.9 tt -65.31 -40.03 93.23 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.104 -0.498 . . . . 72.44 110.911 -179.994 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.664 ' CD1' HG11 ' A' ' 35' ' ' VAL . 36.1 m-85 -77.6 -34.62 53.39 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.147 -0.478 . . . . 54.11 110.881 179.965 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 15.9 t0 -67.21 98.57 0.62 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.134 -0.484 . . . . 61.24 110.892 179.998 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 23.3 mmtp -72.06 -56.46 5.58 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.226 -0.443 . . . . 70.13 110.893 -179.994 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 17.1 p-10 -71.01 -10.24 59.4 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.19 -0.459 . . . . 72.01 110.877 179.859 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 51.54 71.21 0.69 Allowed Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.751 -0.738 . . . . 75.23 112.438 -179.997 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 22.7 p-10 -114.52 -15.75 11.99 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.874 0.368 . . . . 72.42 110.884 179.995 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 101.21 12.37 36.48 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.718 -0.753 . . . . 50.12 112.484 -179.926 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 1.9 p -154.66 144.47 21.62 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.743 0.306 . . . . 73.32 111.133 -179.853 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 22.2 mt -102.93 114.46 42.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.237 -0.438 . . . . 71.22 111.109 179.934 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.782 HG22 HG21 ' A' ' 62' ' ' THR . 19.2 p -102.06 174.91 5.72 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.146 -0.479 . . . . 74.33 111.172 179.945 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.473 HG22 HD12 ' A' ' 52' ' ' ILE . 69.9 p -61.0 -29.97 70.01 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.198 -0.455 . . . . 63.13 111.149 -179.979 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 32.3 mtmt -79.89 -50.12 10.93 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.258 -0.428 . . . . 71.24 110.841 179.96 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.415 ' OE1' HG23 ' A' ' 28' ' ' THR . 50.8 mt-10 -63.34 -35.91 81.95 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.234 -0.439 . . . . 73.32 110.919 179.981 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.0 tt -74.25 -52.2 13.06 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.121 -0.49 . . . . 70.44 110.927 179.983 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -52.17 -29.2 28.48 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.782 -0.723 . . . . 52.22 112.477 179.928 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 95.5 m -66.07 -58.91 4.42 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.853 0.359 . . . . 64.3 111.125 -179.828 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.664 HG11 ' CD1' ' A' ' 19' ' ' PHE . 94.2 t -54.39 -45.95 69.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.216 -0.447 . . . . 72.14 111.141 179.902 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 1.9 mmm -52.18 -38.24 57.2 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.198 -0.455 . . . . 73.21 110.858 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 3.8 tmt_? -55.55 -52.74 62.72 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.214 -0.448 . . . . 63.13 110.921 -179.95 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' SER . . . . . 0.673 ' OG ' HD21 ' M' ' 41' ' ' LEU . 5.9 t -59.89 -29.74 68.53 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.184 -0.462 . . . . 73.12 110.889 -179.813 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 1.03 HD13 ' HB3' ' M' ' 37' ' ' ALA . 48.2 mt -80.26 -21.46 42.72 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.099 -0.5 . . . . 74.04 110.93 179.957 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 101.46 31.02 5.68 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.754 -0.736 . . . . 53.24 112.448 179.868 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -127.4 113.45 16.24 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.814 0.34 . . . . 73.53 110.917 -179.924 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 32.3 t-20 -109.87 81.22 1.95 Allowed Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.628 0.728 . . . . 73.33 110.857 -179.96 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.72 167.95 22.92 Favored 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.673 2.249 . . . . 73.51 112.395 179.887 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 20.2 p -98.44 157.46 16.2 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.239 -0.437 . . . . 63.33 111.153 -179.97 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -52.02 -45.19 64.49 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.245 -0.434 . . . . 74.54 110.834 -179.952 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.555 ' HB3' ' HB2' ' A' ' 139' ' ' GLU . . . -71.07 -31.65 68.1 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.209 -0.45 . . . . 73.31 111.124 179.914 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -66.67 -49.19 66.94 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.206 -0.452 . . . . 60.31 110.871 -179.914 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 16.3 mt -55.17 -50.65 68.77 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.142 -0.481 . . . . 73.43 110.936 -179.96 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 -60.19 -28.6 68.1 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.155 -0.475 . . . . 43.11 110.947 179.919 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 45.4 t0 -74.18 -49.8 21.97 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.19 -0.459 . . . . 71.34 110.87 -179.99 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' MET . . . . . 0.543 ' CE ' HD13 ' M' ' 31' ' ' LEU . 15.6 ptm -66.95 -41.65 86.58 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.153 -0.476 . . . . 62.22 110.926 179.974 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.473 HD12 HG22 ' A' ' 29' ' ' THR . 96.9 mt -66.76 -37.95 80.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.204 -0.453 . . . . 74.3 111.15 179.931 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 37.9 m-20 -63.2 -24.9 68.09 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.143 -0.48 . . . . 60.34 110.842 179.982 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 15.9 mm-40 -73.09 -41.2 64.33 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.194 -0.457 . . . . 74.21 110.886 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 32.6 m -86.37 -17.5 9.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.134 -0.485 . . . . 73.34 111.138 179.991 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 39.0 t0 -66.84 94.1 0.3 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.146 -0.479 . . . . 74.55 110.825 179.978 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.3 -29.79 20.11 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.183 -0.462 . . . . 63.43 111.037 179.974 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -92.86 -0.19 57.29 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.256 -0.429 . . . . 70.15 110.874 -179.976 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 52.18 60.11 8.07 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.739 -0.743 . . . . 51.31 112.498 -179.922 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 44.8 p-10 -114.43 -15.88 12.01 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.896 0.379 . . . . 64.41 110.902 -179.911 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 96.22 8.34 57.77 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.724 -0.75 . . . . 72.21 112.436 179.947 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' THR . . . . . 0.782 HG21 HG22 ' A' ' 28' ' ' THR . 71.9 p -150.61 175.11 12.24 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.772 0.32 . . . . 61.42 111.131 -179.853 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 19.3 mt -101.67 115.6 43.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.204 -0.453 . . . . 65.13 111.146 179.874 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 27.4 m-20 -78.46 -172.88 3.08 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.155 -0.475 . . . . 61.31 110.905 179.837 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.529 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 2.5 t80 -64.83 -58.37 13.28 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 121.632 0.73 . . . . 74.23 110.847 -179.838 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 66' ' ' PRO . . . . . 0.529 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 54.1 Cg_endo -69.75 -31.01 21.41 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.674 2.249 . . . . 74.31 112.34 -179.997 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 19.9 mt-10 -57.45 -41.86 81.37 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.2 -0.455 . . . . 73.52 110.863 -179.942 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 10.6 t80 -73.93 -36.07 64.65 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.174 -0.467 . . . . 73.23 110.908 -179.921 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 16.8 tp -66.68 -53.92 28.67 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.146 -0.479 . . . . 74.5 110.878 -179.986 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 15.3 t -56.21 -31.23 63.3 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.2 -0.455 . . . . 74.31 111.117 179.962 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 41.4 ttp -60.05 -50.37 73.99 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.237 -0.438 . . . . 73.44 110.848 179.95 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' MET . . . . . 0.45 ' HE2' HG21 ' M' ' 35' ' ' VAL . 1.0 OUTLIER -52.83 -44.67 66.88 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.257 -0.429 . . . . 73.25 110.901 179.93 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -72.42 -28.41 62.95 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.189 -0.46 . . . . 63.53 111.104 179.937 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 9.0 ttm-85 -63.82 -16.79 62.14 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.176 -0.465 . . . . 75.42 110.873 -179.893 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -55.44 -20.8 13.56 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.204 -0.453 . . . . 73.41 110.881 179.936 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 3.8 ttt -54.18 -60.65 3.06 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.264 -0.426 . . . . 72.54 110.902 179.843 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 58.6 mttt -151.15 -171.93 4.07 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.255 -0.43 . . . . 71.43 110.951 179.945 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 63.5 57.54 1.46 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.234 -0.439 . . . . 73.14 110.857 179.873 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' THR . . . . . 0.592 HG21 ' C ' ' M' ' 28' ' ' GLN . 2.9 m -161.29 128.53 4.09 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.157 -0.474 . . . . 71.42 111.124 -179.911 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -173.51 -38.47 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.21 -0.45 . . . . 62.2 110.878 179.932 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 20.1 m -58.44 -27.48 64.4 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.213 -0.449 . . . . 65.15 110.861 -179.768 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 15.4 mm-40 -98.81 -45.52 5.98 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.18 -0.464 . . . . 71.34 110.92 -179.969 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 -59.69 -38.17 80.83 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.128 -0.487 . . . . 71.15 110.884 -179.94 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 16.5 tp10 -60.48 -43.24 97.17 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.144 -0.48 . . . . 64.11 110.886 -179.906 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.817 HG21 HG22 ' A' ' 142' ' ' VAL . 32.4 mt -75.19 -51.01 22.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.13 -0.486 . . . . 62.13 111.108 179.976 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 2.3 tmt_? -56.26 -53.63 54.95 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.187 -0.461 . . . . 64.11 110.856 -179.987 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.729 ' O ' HG23 ' A' ' 91' ' ' VAL . 11.7 tm-20 -56.77 -56.08 26.06 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.173 -0.467 . . . . 72.42 110.885 -179.948 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -53.33 -50.93 63.97 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.204 -0.453 . . . . 43.13 111.113 179.921 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 5.1 t80 -61.03 -35.15 76.14 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.237 -0.438 . . . . 73.24 110.832 -179.888 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 14.8 ttt-85 -72.42 -27.48 62.36 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.136 -0.484 . . . . 64.21 110.911 -179.928 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 91' ' ' VAL . . . . . 0.729 HG23 ' O ' ' A' ' 87' ' ' GLU . 86.2 t -75.12 -28.02 20.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.176 -0.465 . . . . 75.12 111.14 179.98 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 8.7 m-85 -95.72 -30.34 13.79 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.152 -0.476 . . . . 74.3 110.872 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 43.7 t0 -76.68 89.41 3.36 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.168 -0.469 . . . . 72.32 110.883 179.995 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 34.0 mmtt -78.02 -48.77 15.41 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.185 -0.461 . . . . 64.11 110.929 179.982 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 9.5 p30 -72.58 -9.09 58.16 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.237 -0.438 . . . . 74.11 110.841 179.903 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 60.04 28.83 66.95 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.7 -0.762 . . . . 65.24 112.504 -179.933 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 43.8 p-10 -81.89 -16.1 51.77 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.89 0.376 . . . . 72.01 110.915 -179.885 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 82.36 18.72 65.93 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.746 -0.74 . . . . 43.12 112.5 179.966 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 19.0 m-85 -137.56 136.63 37.78 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.849 0.357 . . . . 54.03 110.917 -179.76 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 79.9 mt -106.05 124.94 61.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.141 -0.482 . . . . 72.13 111.112 179.939 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 40.2 p -116.45 176.22 5.21 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.175 -0.466 . . . . 72.31 110.883 -179.945 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -60.28 -38.88 84.95 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.12 -0.491 . . . . 65.55 111.13 179.881 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -62.42 -39.6 93.83 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.211 -0.449 . . . . 63.11 111.074 179.933 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 104' ' ' GLU . . . . . 0.725 ' O ' HG23 ' A' ' 108' ' ' VAL . 54.6 mt-10 -73.46 -51.56 16.76 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.207 -0.451 . . . . 73.44 110.874 -179.926 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.424 HD11 HD13 ' M' ' 19' ' ' ILE . 17.2 tp -56.2 -44.52 79.54 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.195 -0.457 . . . . 73.04 110.918 -179.955 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 27.5 ttt180 -52.59 -49.2 65.48 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.211 -0.45 . . . . 72.45 110.832 179.958 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 81.0 t60 -65.57 -34.81 79.11 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.18 -0.463 . . . . 74.32 110.86 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.725 HG23 ' O ' ' A' ' 104' ' ' GLU . 91.2 t -59.18 -52.28 62.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.229 -0.442 . . . . 55.42 111.145 179.974 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 2.2 tpt -56.16 -36.35 68.21 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.19 -0.459 . . . . 64.24 110.875 179.893 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -53.56 -35.26 60.58 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.261 -0.427 . . . . 71.04 111.129 -179.917 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 5.2 t30 -74.53 -26.57 60.06 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.197 -0.456 . . . . 74.21 110.897 -179.985 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 15.4 mt -77.73 -25.37 49.25 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.141 -0.481 . . . . 74.44 110.894 179.976 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 101.07 32.97 5.11 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.716 -0.754 . . . . 43.05 112.498 179.877 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 21.2 mm-40 -129.43 110.11 11.62 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.931 0.396 . . . . 72.34 110.85 -179.852 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 115' ' ' LYS . . . . . 0.426 ' O ' HD23 ' A' ' 116' ' ' LEU . 20.8 pttp -72.59 135.83 45.63 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.104 -0.498 . . . . 52.0 110.901 179.961 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.558 HD21 ' HD3' ' M' ' 15' ' ' LYS . 75.0 mt -138.23 157.57 46.02 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.259 -0.428 . . . . 62.53 110.894 179.914 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 69.6 p -107.74 163.26 13.25 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.184 -0.462 . . . . 72.54 111.146 179.959 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 14.2 m-20 -52.12 -40.87 61.96 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.219 -0.446 . . . . 53.41 110.844 179.913 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 59.7 tt0 -72.98 -33.52 65.88 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.185 -0.461 . . . . 71.43 110.898 -179.881 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 120' ' ' GLU . . . . . 0.497 ' HG2' HD22 ' A' ' 116' ' ' LEU . 6.1 tp10 -66.5 -44.33 82.85 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.109 -0.496 . . . . 72.04 110.904 -179.953 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 91.1 t -57.81 -31.07 39.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.152 -0.476 . . . . 63.54 111.08 -179.994 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 19.0 t0 -59.62 -45.39 92.08 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.235 -0.439 . . . . 74.14 110.859 179.928 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -55.81 -30.3 61.15 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.182 -0.463 . . . . 73.02 110.888 -179.909 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 4.3 mtt -76.01 -59.41 2.77 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.111 -0.495 . . . . 73.12 110.929 179.956 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 36.1 mm -53.99 -35.5 28.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.234 -0.439 . . . . 75.4 111.138 179.973 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 52.8 ttt85 -63.01 -31.79 73.01 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.178 -0.464 . . . . 75.25 110.875 179.944 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 31.7 tp10 -75.14 -52.44 10.99 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.164 -0.471 . . . . 72.32 110.895 -179.912 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.511 ' HB3' HG22 ' A' ' 136' ' ' VAL . . . -64.86 -34.47 78.46 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.149 -0.478 . . . . 65.42 111.119 179.889 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 48.7 t0 -68.46 86.93 0.3 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.219 -0.446 . . . . 73.42 110.861 -179.973 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 130' ' ' ILE . . . . . 0.764 HD12 ' HG2' ' A' ' 140' ' ' GLU . 7.8 mt -79.97 -46.88 22.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.184 -0.462 . . . . 75.45 111.108 -179.984 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 21.1 p30 -72.47 -8.84 57.18 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.199 -0.455 . . . . 74.51 110.908 179.836 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 63.15 44.47 97.12 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.767 -0.73 . . . . 72.25 112.476 -179.97 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 35.5 p-10 -90.67 -15.95 29.45 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.86 0.362 . . . . 60.33 110.883 -179.948 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 102.79 3.02 49.54 Favored Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 120.75 -0.738 . . . . 73.42 112.492 -179.96 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 5.3 tt0 -149.27 172.3 15.09 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.824 0.345 . . . . 75.12 110.932 -179.925 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 136' ' ' VAL . . . . . 0.511 HG22 ' HB3' ' A' ' 128' ' ' ALA . 60.0 t -112.03 109.1 27.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.236 -0.438 . . . . 54.33 111.133 179.991 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 17.2 p30 -90.52 173.04 8.29 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.205 -0.452 . . . . 74.11 110.916 179.985 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 138' ' ' TYR . . . . . 0.666 ' O ' HG23 ' A' ' 142' ' ' VAL . 55.4 t80 -58.75 -47.44 84.64 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.213 -0.449 . . . . 72.14 110.94 -179.926 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 139' ' ' GLU . . . . . 0.555 ' HB2' ' HB3' ' A' ' 46' ' ' ALA . 78.4 tt0 -51.89 -39.69 59.44 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.095 -0.502 . . . . 72.24 110.929 179.986 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 140' ' ' GLU . . . . . 0.764 ' HG2' HD12 ' A' ' 130' ' ' ILE . 89.6 mt-10 -78.09 -38.31 44.45 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.135 -0.484 . . . . 71.04 110.876 -179.938 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 51.7 t80 -63.19 -35.55 80.69 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.195 -0.457 . . . . 74.2 110.841 -179.93 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 142' ' ' VAL . . . . . 0.817 HG22 HG21 ' A' ' 85' ' ' ILE . 99.5 t -64.43 -44.43 97.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.149 -0.478 . . . . 75.15 111.138 -179.99 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 14.5 tt0 -74.03 -30.49 62.46 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.138 -0.483 . . . . 73.33 110.901 -179.993 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 6.9 tpt -73.1 -30.68 63.84 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.177 -0.465 . . . . 52.31 110.88 -179.999 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 145' ' ' MET . . . . . 0.518 ' HE1' HG22 ' M' ' 19' ' ' ILE . 0.0 OUTLIER -82.48 -26.22 32.8 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.241 -0.436 . . . . 73.34 110.865 179.954 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 87.3 m -85.3 -25.64 27.08 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.217 -0.447 . . . . 73.44 111.172 -179.927 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -60.42 115.73 3.78 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.23 -0.441 . . . . 71.11 111.072 179.863 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 52.6 tttm . . . . . 0 C--N 1.329 -0.297 0 CA-C-N 116.225 -0.443 . . . . 75.44 110.911 179.968 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' M' M ' 8' ' ' LEU . . . . . . . . . . . . . 18.9 mt . . . . . 0 C--O 1.23 0.076 0 CA-C-O 120.859 0.361 . . . . 74.33 110.896 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' M' M ' 9' ' ' SER . . . . . . . . . . . . . 5.2 p -123.48 178.78 5.02 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.176 -0.465 . . . . 60.21 110.891 -179.99 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' M' M ' 10' ' ' GLY . . . . . . . . . . . . . . . -165.34 -119.63 0.49 Allowed Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.739 -0.743 . . . . 74.41 112.48 -179.938 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' M' M ' 11' ' ' GLY . . . . . . . . . . . . . . . -80.16 -42.01 11.28 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.738 -0.744 . . . . 52.21 112.463 -179.898 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' M' M ' 12' ' ' GLU . . . . . . . . . . . . . 5.5 pt-20 -110.78 -174.68 2.53 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.865 0.364 . . . . 74.33 110.916 -179.919 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' M' M ' 13' ' ' LEU . . . . . 0.771 HD22 ' HG2' ' M' ' 15' ' ' LYS . 2.5 tt -88.52 129.22 35.51 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.151 -0.477 . . . . 60.35 110.912 -179.962 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' M' M ' 14' ' ' ASP . . . . . 0.602 ' N ' HD23 ' M' ' 13' ' ' LEU . 34.6 t0 -79.51 58.77 2.77 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.131 -0.486 . . . . 44.35 110.846 179.882 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' M' M ' 15' ' ' LYS . . . . . 0.771 ' HG2' HD22 ' M' ' 13' ' ' LEU . 12.8 mttm -67.48 -43.12 81.73 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.185 -0.461 . . . . 65.43 110.87 179.992 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' M' M ' 16' ' ' TRP . . . . . 0.713 ' CE3' HD12 ' M' ' 19' ' ' ILE . 7.8 m95 -51.79 -46.63 64.26 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.21 -0.45 . . . . 71.41 110.906 179.957 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' M' M ' 17' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -56.17 -28.44 58.1 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.262 -0.426 . . . . 71.32 110.882 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' M' M ' 18' ' ' LYS . . . . . . . . . . . . . 6.2 ttpm? -76.7 -26.01 54.24 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.15 -0.477 . . . . 62.02 110.883 179.98 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' M' M ' 19' ' ' ILE . . . . . 0.713 HD12 ' CE3' ' M' ' 16' ' ' TRP . 76.6 mt -79.35 -22.66 12.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.259 -0.428 . . . . 71.11 111.126 179.871 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' M' M ' 20' ' ' ARG . . . . . . . . . . . . . 47.7 ttp85 -68.79 -28.21 66.57 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.188 -0.46 . . . . 74.21 110.874 179.993 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' M' M ' 21' ' ' LEU . . . . . . . . . . . . . 6.8 mt 63.23 -169.94 0.18 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.178 -0.464 . . . . 75.12 110.898 -179.96 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' M' M ' 22' ' ' ARG . . . . . . . . . . . . . 7.2 mmt85 -106.95 158.8 32.01 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.65 0.738 . . . . 75.51 110.821 179.963 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' M' M ' 23' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.73 90.81 0.51 Allowed 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.716 2.277 . . . . 70.11 112.318 -179.987 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' M' M ' 24' ' ' GLY . . . . . . . . . . . . . . . 172.24 118.31 0.48 Allowed Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.786 -0.721 . . . . 62.23 112.534 179.991 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' M' M ' 25' ' ' GLY . . . . . . . . . . . . . . . 173.47 -151.9 14.45 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.778 -0.725 . . . . 62.15 112.518 -179.923 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' M' M ' 26' ' ' LYS . . . . . . . . . . . . . 11.3 mmtp -52.09 164.93 0.24 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.831 0.348 . . . . 65.24 110.917 179.972 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' M' M ' 27' ' ' LYS . . . . . . . . . . . . . 31.4 mtmm -148.42 103.04 3.39 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.26 -0.427 . . . . 71.32 110.894 179.849 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' M' M ' 28' ' ' GLN . . . . . 0.592 ' C ' HG21 ' A' ' 79' ' ' THR . 8.0 tt0 -177.0 141.46 0.34 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.204 -0.453 . . . . 74.15 110.912 179.964 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' M' M ' 29' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -51.99 149.43 5.06 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.207 -0.451 . . . . 75.55 110.918 -179.861 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' M' M ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.22 23.73 5.55 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.105 -0.498 . . . . 64.12 110.898 179.879 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' M' M ' 31' ' ' LEU . . . . . 0.543 HD13 ' CE ' ' A' ' 51' ' ' MET . 19.6 tp -130.08 -44.33 1.16 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.24 -0.437 . . . . 62.35 110.905 179.899 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' M' M ' 32' ' ' LYS . . . . . 0.404 ' O ' HG23 ' M' ' 35' ' ' VAL . 3.2 tttt -49.15 -43.71 42.02 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.201 -0.454 . . . . 73.04 110.925 179.849 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' M' M ' 33' ' ' HIS . . . . . . . . . . . . . 11.9 t60 -50.92 -39.01 53.63 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.227 -0.442 . . . . 72.13 110.841 179.853 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' M' M ' 34' ' ' ILE . . . . . . . . . . . . . 50.3 mm -51.26 -38.18 19.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.24 -0.436 . . . . 63.4 111.151 179.994 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' M' M ' 35' ' ' VAL . . . . . 0.45 HG21 ' HE2' ' A' ' 72' ' ' MET . 44.1 t -48.88 -38.84 10.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.2 -0.454 . . . . 71.53 111.18 179.819 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' M' M ' 36' ' ' TRP . . . . . . . . . . . . . 20.1 m0 -58.46 -40.31 82.32 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.154 -0.475 . . . . 65.42 110.871 179.975 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' M' M ' 37' ' ' ALA . . . . . 1.03 ' HB3' HD13 ' A' ' 39' ' ' LEU . . . -63.89 -18.85 64.6 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.283 -0.417 . . . . 72.11 111.089 179.891 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' M' M ' 38' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -81.39 -17.79 47.76 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.215 -0.448 . . . . 75.03 110.882 -179.763 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' M' M ' 39' ' ' ARG . . . . . . . . . . . . . 20.3 ttt-85 -54.99 -26.63 38.12 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.129 -0.487 . . . . 74.1 110.906 -179.975 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' M' M ' 40' ' ' GLU . . . . . . . . . . . . . 71.9 mt-10 -87.35 -45.69 10.34 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.166 -0.47 . . . . 74.12 110.892 -179.948 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' M' M ' 41' ' ' LEU . . . . . 0.673 HD21 ' OG ' ' A' ' 38' ' ' SER . 10.7 mt -52.77 110.28 0.5 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.153 -0.476 . . . . 70.23 110.92 179.994 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' M' M ' 42' ' ' GLU . . . . . . . . . . . . . 29.5 mt-10 52.27 79.66 0.11 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.163 -0.471 . . . . 72.32 110.898 179.951 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' M' M ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.328 0 CA-C-N 116.191 -0.459 . . . . 74.12 110.917 -179.952 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 241' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 262' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 301' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 322' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.101 0 CA-C-O 120.738 0.304 . . . . 54.4 111.135 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 59.24 83.9 0.12 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.227 -0.442 . . . . 72.44 110.88 179.98 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 12.8 mp0 -54.43 -71.51 0.08 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.17 -0.468 . . . . 62.11 110.896 -179.88 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.484 HD13 ' CG ' ' A' ' 8' ' ' GLN . 4.1 mm? -83.81 109.32 17.44 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.198 -0.455 . . . . 61.25 110.935 179.984 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 41.2 p -97.1 174.08 6.93 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.189 -0.46 . . . . 73.21 111.167 179.944 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 15.9 tm-20 -56.33 -37.83 70.49 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.254 -0.43 . . . . 63.03 110.879 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 47.1 tt0 -67.63 -33.72 75.55 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.172 -0.467 . . . . 71.25 110.851 -179.907 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' GLN . . . . . 0.484 ' CG ' HD13 ' A' ' 4' ' ' LEU . 9.1 tp-100 -78.03 -42.41 32.55 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.166 -0.47 . . . . 74.33 110.92 -179.905 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 59.5 mt -70.84 -45.48 73.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.161 -0.472 . . . . 72.03 111.125 179.969 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -54.73 -29.01 52.43 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.168 -0.469 . . . . 72.12 111.089 179.845 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 34.7 mm-40 -74.58 -52.23 12.37 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.212 -0.449 . . . . 71.34 110.915 -179.923 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 24.5 m-85 -63.05 -46.01 89.52 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.142 -0.481 . . . . 62.42 110.871 -179.924 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 2.5 tmtm? -54.69 -34.8 62.85 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.154 -0.475 . . . . 74.14 110.889 179.97 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 49.1 tt0 -64.91 -33.32 75.75 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.2 -0.455 . . . . 61.14 110.852 -179.994 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -66.8 -41.35 87.75 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.177 -0.465 . . . . 71.12 111.106 179.945 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 88.8 t80 -61.5 -54.28 45.29 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.194 -0.457 . . . . 72.23 110.877 -179.929 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 22.6 t -57.19 -26.45 60.66 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.15 -0.477 . . . . 51.22 110.858 -179.785 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.492 HD23 ' HB3' ' M' ' 38' ' ' SER . 15.3 tp -66.85 -44.32 81.35 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.136 -0.484 . . . . 75.32 110.921 -179.955 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.693 ' CD1' HG11 ' A' ' 35' ' ' VAL . 36.8 m-85 -74.61 -30.79 61.79 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.166 -0.47 . . . . 73.2 110.876 179.924 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 17.9 t0 -72.73 98.69 2.44 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.114 -0.494 . . . . 63.43 110.878 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 19.3 mtpp -68.97 -53.3 21.41 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.147 -0.479 . . . . 65.21 110.93 179.961 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 20.8 p-10 -74.18 -10.47 59.64 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.184 -0.462 . . . . 71.5 110.856 179.876 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 50.94 43.6 49.19 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.719 -0.753 . . . . 72.43 112.504 -179.918 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 35.7 p-10 -88.04 -15.61 35.88 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.824 0.345 . . . . 54.51 110.856 -179.966 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 105.38 -11.58 47.38 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.727 -0.749 . . . . 63.13 112.511 -179.922 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 9.9 p -132.99 130.7 39.84 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.764 0.316 . . . . 72.31 111.13 -179.891 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 22.2 mt -86.6 122.7 39.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.203 -0.453 . . . . 72.41 111.168 179.898 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 81.6 p -98.28 176.94 5.53 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.199 -0.455 . . . . 73.3 111.14 179.98 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.708 HG22 HD12 ' A' ' 52' ' ' ILE . 62.4 p -65.22 -45.05 86.27 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.222 -0.445 . . . . 71.12 111.147 -179.98 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 21.2 mtmm -64.22 -42.83 96.4 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.219 -0.446 . . . . 72.22 110.858 179.91 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -67.48 -32.7 73.72 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.248 -0.433 . . . . 72.52 110.844 -179.992 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.582 HD12 ' CD2' ' A' ' 48' ' ' LEU . 1.0 OUTLIER -68.35 -44.73 74.62 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.191 -0.459 . . . . 72.53 110.934 -179.95 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -71.76 -27.87 70.06 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.722 -0.752 . . . . 52.01 112.482 179.875 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 94.5 m -63.95 -54.22 37.96 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.808 0.337 . . . . 55.21 111.211 -179.889 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.693 HG11 ' CD1' ' A' ' 19' ' ' PHE . 47.2 t -58.18 -53.29 47.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.173 -0.467 . . . . 43.42 111.138 179.882 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 2.2 mtt -52.01 -36.61 50.52 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.181 -0.463 . . . . 75.42 110.856 179.938 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 34.5 ttt-85 -54.1 -46.7 72.15 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.204 -0.453 . . . . 74.41 110.859 -179.917 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' SER . . . . . 0.632 ' OG ' HD21 ' M' ' 41' ' ' LEU . 3.1 t -68.81 -26.2 65.06 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.201 -0.454 . . . . 74.32 110.892 -179.805 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.986 HD13 ' HB3' ' M' ' 37' ' ' ALA . 39.0 mt -82.73 -18.16 41.77 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.114 -0.494 . . . . 73.01 110.918 179.974 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 101.55 28.61 6.62 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.76 -0.733 . . . . 61.13 112.496 179.924 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 8.1 mm100 -116.7 123.26 46.79 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.801 0.334 . . . . 71.12 110.923 -179.89 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 32.5 t-20 -109.91 76.76 1.0 Allowed Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 121.638 0.732 . . . . 63.2 110.876 -179.929 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.7 168.06 22.58 Favored 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.672 2.248 . . . . 65.3 112.314 179.939 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 19.5 p -112.77 154.09 26.76 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.177 -0.465 . . . . 71.12 111.118 -179.951 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 12.3 tp10 -51.96 -38.81 57.88 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.23 -0.441 . . . . 63.2 110.831 -179.991 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.34 -31.5 64.01 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.167 -0.47 . . . . 74.31 111.05 179.974 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 21.4 tt0 -72.94 -52.7 13.57 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.246 -0.434 . . . . 73.22 110.893 -179.924 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.582 ' CD2' HD12 ' A' ' 32' ' ' LEU . 34.6 mt -56.07 -49.14 74.61 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.145 -0.48 . . . . 74.44 110.893 -179.942 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 12.8 tp60 -56.86 -29.01 62.51 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.207 -0.451 . . . . 72.5 110.923 179.909 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -75.5 -49.66 18.08 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.168 -0.469 . . . . 75.23 110.891 179.966 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 32.6 mtp -60.61 -54.84 40.54 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.211 -0.45 . . . . 63.35 110.895 179.956 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.708 HD12 HG22 ' A' ' 29' ' ' THR . 65.9 mt -53.18 -42.83 47.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.264 -0.425 . . . . 65.11 111.123 179.934 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 76.0 m-20 -71.21 -27.09 63.24 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.204 -0.453 . . . . 61.33 110.865 179.974 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 10.8 tt0 -67.89 -28.95 67.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.195 -0.457 . . . . 73.32 110.893 179.994 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.499 HG13 ' CE2' ' M' ' 29' ' ' TYR . 3.4 m -112.03 16.92 7.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.155 -0.475 . . . . 62.22 111.133 179.951 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 28.8 t0 -88.89 99.55 12.49 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.198 -0.456 . . . . 73.44 110.854 179.908 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.3 -37.72 15.76 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.148 -0.478 . . . . 73.25 111.082 179.942 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -88.66 -0.32 57.17 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.222 -0.445 . . . . 62.4 110.866 179.981 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 51.37 57.89 10.93 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.746 -0.74 . . . . 43.32 112.466 -179.963 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 48.8 p-10 -114.56 -15.73 11.97 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.884 0.373 . . . . 73.15 110.894 -179.896 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 89.84 19.22 48.48 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.777 -0.725 . . . . 53.51 112.546 179.985 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 44.3 p -148.34 168.28 23.02 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.764 0.316 . . . . 73.2 111.144 -179.885 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.489 HD11 ' HA ' ' A' ' 52' ' ' ILE . 13.3 mm -100.93 109.48 25.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.214 -0.448 . . . . 74.14 111.15 179.894 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -76.2 -173.49 2.43 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.193 -0.458 . . . . 73.53 110.848 179.902 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.524 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 2.5 t80 -64.57 -58.51 13.27 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-O 121.651 0.738 . . . . 74.33 110.861 -179.895 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 66' ' ' PRO . . . . . 0.524 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 54.5 Cg_endo -69.69 -30.34 22.77 Favored 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 122.699 2.266 . . . . 51.54 112.38 179.981 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 18.1 mt-10 -57.17 -40.78 77.99 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.221 -0.445 . . . . 74.25 110.847 -179.957 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 12.5 t80 -74.11 -36.1 64.2 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.143 -0.48 . . . . 72.12 110.898 -179.918 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 29.0 tp -67.28 -53.74 27.14 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.137 -0.483 . . . . 75.12 110.935 -179.942 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 12.6 t -53.13 -27.56 21.43 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.173 -0.467 . . . . 73.31 111.101 179.941 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 56.1 ttp -67.51 -42.72 82.35 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.24 -0.436 . . . . 74.31 110.891 179.919 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 2.7 mtt -79.82 -31.71 40.62 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.214 -0.448 . . . . 71.03 110.863 179.998 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -66.52 -35.34 80.02 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.23 -0.441 . . . . 61.13 111.103 179.877 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 41.7 ttt180 -56.24 -25.26 47.04 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.236 -0.438 . . . . 62.42 110.866 -179.882 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -68.84 -35.31 76.8 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.195 -0.457 . . . . 51.35 110.908 179.928 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 4.5 tpt -56.08 -42.3 76.47 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.233 -0.44 . . . . 74.33 110.894 179.869 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 33.8 ttpt -68.58 113.2 5.88 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.205 -0.452 . . . . 65.22 110.913 179.948 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -152.71 166.73 31.26 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.242 -0.436 . . . . 74.1 110.828 179.897 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 3.5 m -103.94 -42.69 5.5 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.174 -0.466 . . . . 71.13 111.133 -179.889 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -55.03 -30.99 60.71 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.185 -0.462 . . . . 75.14 110.855 179.917 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 1.6 t -55.57 -37.42 68.02 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.172 -0.467 . . . . 75.22 110.874 -179.779 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.712 ' HA ' HD12 ' A' ' 85' ' ' ILE . 8.5 tt0 -52.92 -33.07 48.89 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.149 -0.478 . . . . 72.33 110.897 -179.979 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 4.2 tm-20 -67.65 -48.25 67.22 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.154 -0.475 . . . . 64.35 110.894 -179.898 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -59.3 -26.66 65.17 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.132 -0.486 . . . . 74.32 110.908 -179.989 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.743 HD13 HG13 ' A' ' 142' ' ' VAL . 58.2 mt -74.04 -51.13 25.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.165 -0.471 . . . . 73.23 111.135 179.959 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 13.5 ttt85 -61.7 -28.21 69.25 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.157 -0.474 . . . . 71.32 110.887 179.982 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.727 ' O ' HG23 ' A' ' 91' ' ' VAL . 17.5 tt0 -67.36 -58.01 5.58 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.199 -0.455 . . . . 75.03 110.886 -179.941 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 88' ' ' ALA . . . . . 0.449 ' HB1' ' CE2' ' A' ' 92' ' ' PHE . . . -59.52 -47.38 85.76 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.196 -0.457 . . . . 54.31 111.086 179.927 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -52.03 -43.89 63.95 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.181 -0.463 . . . . 74.53 110.866 -179.878 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 60.8 ttt180 -69.53 -32.19 70.87 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.135 -0.484 . . . . 73.24 110.899 -179.917 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 91' ' ' VAL . . . . . 0.727 HG23 ' O ' ' A' ' 87' ' ' GLU . 90.8 t -68.5 -27.76 37.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.172 -0.467 . . . . 64.31 111.13 179.957 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.449 ' CE2' ' HB1' ' A' ' 88' ' ' ALA . 9.1 m-85 -93.68 -33.33 13.69 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.198 -0.455 . . . . 74.52 110.904 179.994 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 25.8 t0 -64.25 96.75 0.16 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.159 -0.473 . . . . 75.21 110.874 179.965 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 7.4 tppt? -78.72 -53.21 7.38 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.16 -0.473 . . . . 73.41 110.914 -179.992 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 56.4 p-10 -72.85 -9.07 58.26 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.249 -0.432 . . . . 75.51 110.891 179.848 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 59.63 26.68 62.73 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.772 -0.727 . . . . 63.45 112.448 -179.981 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 39.3 p-10 -81.8 -16.14 51.91 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.869 0.366 . . . . 63.42 110.895 -179.864 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 88.48 18.72 54.53 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.727 -0.749 . . . . 74.3 112.441 179.946 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 19.0 m-85 -140.52 150.19 43.41 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.889 0.376 . . . . 74.31 110.944 -179.823 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 62.3 mt -120.98 133.48 67.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.111 -0.495 . . . . 53.42 111.157 179.907 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 97.8 p -114.44 177.74 4.53 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.174 -0.466 . . . . 72.54 110.897 -179.896 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 102' ' ' ALA . . . . . 0.679 ' O ' HG11 ' A' ' 121' ' ' VAL . . . -60.66 -34.54 74.45 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.201 -0.454 . . . . 72.1 111.081 179.927 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -71.9 -49.33 38.78 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.279 -0.419 . . . . 70.11 111.093 179.966 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 17.4 mt-10 -63.01 -46.52 87.27 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.202 -0.454 . . . . 51.41 110.893 -179.922 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 26.4 tp -52.98 -42.7 65.79 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.137 -0.483 . . . . 73.23 110.887 -179.977 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 106' ' ' ARG . . . . . 0.705 ' HB2' HG21 ' A' ' 121' ' ' VAL . 5.9 ttt-85 -62.13 -34.95 77.33 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.219 -0.446 . . . . 71.14 110.873 179.952 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 16.5 t60 -58.52 -34.9 71.48 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.175 -0.466 . . . . 74.44 110.871 179.998 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.591 ' O ' HD12 ' A' ' 112' ' ' LEU . 58.0 t -70.99 -39.17 74.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.242 -0.435 . . . . 64.22 111.084 -179.99 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 109' ' ' MET . . . . . 0.619 ' CB ' HD12 ' A' ' 116' ' ' LEU . 5.1 mmt -76.43 -26.67 55.73 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.229 -0.441 . . . . 75.54 110.885 179.917 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 40.4 m -71.66 -56.04 6.57 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.221 -0.445 . . . . 74.24 111.164 -179.952 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -56.09 -31.16 62.99 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.219 -0.446 . . . . 72.12 110.921 179.956 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.591 HD12 ' O ' ' A' ' 108' ' ' VAL . 3.2 mt -71.46 -25.86 62.47 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.137 -0.483 . . . . 73.44 110.931 179.982 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 100.95 33.01 5.13 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.777 -0.725 . . . . 62.23 112.508 179.933 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 29.6 tp10 -110.08 110.18 20.98 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.932 0.396 . . . . 75.23 110.875 -179.896 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 30.9 mttm -60.79 102.68 0.2 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.124 -0.489 . . . . 73.2 110.894 179.984 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.619 HD12 ' CB ' ' A' ' 109' ' ' MET . 81.1 mt -138.95 146.76 41.39 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.222 -0.445 . . . . 52.25 110.937 179.893 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 117' ' ' THR . . . . . 0.611 ' O ' HG23 ' A' ' 121' ' ' VAL . 41.8 p -112.62 175.12 5.57 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.185 -0.461 . . . . 71.41 111.131 179.934 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -57.1 -45.05 83.71 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.175 -0.466 . . . . 73.23 110.877 179.882 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 13.6 tp10 -62.55 -33.64 75.33 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.174 -0.466 . . . . 70.21 110.871 -179.898 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 18.5 tt0 -73.84 -31.4 63.18 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.184 -0.462 . . . . 75.21 110.91 -179.942 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.705 HG21 ' HB2' ' A' ' 106' ' ' ARG . 65.0 t -72.5 -30.72 35.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.135 -0.484 . . . . 61.41 111.083 -179.986 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -51.94 -47.24 64.8 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.193 -0.458 . . . . 74.43 110.86 179.928 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 123' ' ' GLU . . . . . 0.649 ' HG2' HD23 ' M' ' 13' ' ' LEU . 13.0 tp10 -56.79 -29.51 62.75 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.201 -0.454 . . . . 73.11 110.917 -179.917 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 17.2 mtp -73.96 -59.01 2.92 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.129 -0.487 . . . . 72.4 110.898 179.973 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 35.4 mm -53.93 -35.76 28.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.211 -0.45 . . . . 74.52 111.161 179.926 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 63.8 ttt180 -65.13 -31.83 73.22 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.15 -0.477 . . . . 71.22 110.888 179.944 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -72.46 -50.2 27.82 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.158 -0.474 . . . . 73.34 110.871 -179.931 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.614 ' HB3' HG22 ' A' ' 136' ' ' VAL . . . -69.36 -34.01 73.94 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.204 -0.453 . . . . 74.32 111.064 179.961 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 50.3 t0 -68.41 86.6 0.29 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.229 -0.442 . . . . 72.43 110.818 -179.984 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 60.0 mt -79.93 -45.56 22.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.221 -0.445 . . . . 73.2 111.091 179.969 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 22.6 p30 -72.73 -8.79 57.12 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.192 -0.458 . . . . 73.33 110.827 179.928 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 62.77 43.34 99.1 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.717 -0.754 . . . . 50.33 112.512 -179.932 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 32.5 p-10 -88.69 -16.02 33.38 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.902 0.382 . . . . 53.42 110.888 -179.944 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 103.37 2.94 47.67 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.691 -0.766 . . . . 34.03 112.482 -179.936 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 5.1 tt0 -149.25 172.26 15.15 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.799 0.333 . . . . 71.02 110.898 -179.861 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 136' ' ' VAL . . . . . 0.614 HG22 ' HB3' ' A' ' 128' ' ' ALA . 96.1 t -109.89 118.69 57.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.181 -0.463 . . . . 74.52 111.143 179.963 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 44.2 p-10 -102.16 166.85 10.37 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.204 -0.453 . . . . 65.34 110.928 179.989 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 138' ' ' TYR . . . . . 0.704 ' O ' HG23 ' A' ' 142' ' ' VAL . 48.0 t80 -51.9 -45.62 64.26 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.206 -0.452 . . . . 72.34 110.913 -179.893 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 6.1 tm-20 -53.4 -40.61 65.19 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.122 -0.49 . . . . 74.4 110.833 -179.941 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 17.5 mt-10 -78.43 -34.5 47.82 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.154 -0.476 . . . . 74.02 110.906 -179.91 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 41.1 t80 -67.15 -35.41 79.64 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.184 -0.462 . . . . 72.32 110.856 -179.925 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 142' ' ' VAL . . . . . 0.743 HG13 HD13 ' A' ' 85' ' ' ILE . 97.8 t -64.67 -44.04 96.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.179 -0.464 . . . . 54.41 111.105 -179.998 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 143' ' ' GLN . . . . . 0.56 ' HA ' HG22 ' A' ' 146' ' ' THR . 48.6 tt0 -74.23 -23.84 59.23 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.214 -0.448 . . . . 73.23 110.88 -179.954 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 8.7 tpt -74.99 -18.85 60.3 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.169 -0.469 . . . . 71.12 110.911 179.97 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 9.2 ttm -98.23 -30.75 12.44 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.22 -0.445 . . . . 72.42 110.884 179.971 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 146' ' ' THR . . . . . 0.56 HG22 ' HA ' ' A' ' 143' ' ' GLN . 4.7 t -76.76 -23.56 52.97 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.236 -0.438 . . . . 75.43 111.174 -179.993 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -87.89 -75.51 0.41 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.194 -0.457 . . . . 73.11 111.081 179.846 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 17.0 mttm . . . . . 0 C--N 1.328 -0.336 0 CA-C-N 116.215 -0.448 . . . . 51.55 110.895 179.984 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' M' M ' 8' ' ' LEU . . . . . . . . . . . . . 4.2 pp . . . . . 0 C--O 1.231 0.11 0 CA-C-O 120.815 0.341 . . . . 53.43 110.961 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' M' M ' 9' ' ' SER . . . . . . . . . . . . . 55.2 m -148.13 179.12 7.98 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.203 -0.453 . . . . 71.52 110.867 -179.914 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' M' M ' 10' ' ' GLY . . . . . . . . . . . . . . . -142.24 -177.63 17.5 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.775 -0.726 . . . . 74.41 112.493 -179.972 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' M' M ' 11' ' ' GLY . . . . . . . . . . . . . . . 57.23 24.73 52.49 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.792 -0.718 . . . . 62.41 112.461 -179.937 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' M' M ' 12' ' ' GLU . . . . . . . . . . . . . 1.7 pt-20 -130.48 95.9 4.0 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.874 0.369 . . . . 74.41 110.887 -179.888 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' M' M ' 13' ' ' LEU . . . . . 0.649 HD23 ' HG2' ' A' ' 123' ' ' GLU . 0.9 OUTLIER -87.7 76.08 8.89 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.142 -0.481 . . . . 74.32 110.972 179.98 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' M' M ' 14' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -102.02 23.61 11.27 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.209 -0.45 . . . . 71.03 110.889 179.862 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' M' M ' 15' ' ' LYS . . . . . . . . . . . . . 40.5 mttp -79.09 -45.18 20.58 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.159 -0.473 . . . . 62.2 110.875 179.987 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' M' M ' 16' ' ' TRP . . . . . 0.514 ' CE3' HD12 ' M' ' 19' ' ' ILE . 24.2 m95 -53.77 -34.5 59.21 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.278 -0.419 . . . . 73.14 110.926 179.964 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' M' M ' 17' ' ' GLU . . . . . . . . . . . . . 5.3 tm-20 -58.67 -25.91 63.27 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.229 -0.441 . . . . 73.01 110.884 179.997 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' M' M ' 18' ' ' LYS . . . . . 0.568 ' NZ ' HD13 ' A' ' 112' ' ' LEU . 16.0 ttpp -67.66 -26.85 66.41 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.185 -0.461 . . . . 71.52 110.91 179.951 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' M' M ' 19' ' ' ILE . . . . . 0.514 HD12 ' CE3' ' M' ' 16' ' ' TRP . 28.2 mt -92.61 -22.81 5.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.215 -0.448 . . . . 51.14 111.13 179.879 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' M' M ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.63 -45.55 61.7 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.165 -0.471 . . . . 73.13 110.856 179.983 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' M' M ' 21' ' ' LEU . . . . . . . . . . . . . 8.1 mt 63.08 -174.81 0.15 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.192 -0.458 . . . . 74.41 110.923 -179.978 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' M' M ' 22' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -121.86 144.88 42.02 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.622 0.725 . . . . 73.33 110.848 179.938 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' M' M ' 23' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.75 -47.74 0.87 Allowed 'Trans proline' 0 C--N 1.341 0.163 0 C-N-CA 122.676 2.251 . . . . 72.25 112.346 179.988 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' M' M ' 24' ' ' GLY . . . . . . . . . . . . . . . 109.35 120.45 4.31 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.747 -0.74 . . . . 60.21 112.461 179.964 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' M' M ' 25' ' ' GLY . . . . . . . . . . . . . . . 69.4 117.75 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.697 -0.763 . . . . 51.42 112.527 -179.906 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' M' M ' 26' ' ' LYS . . . . . . . . . . . . . 29.9 mmtp -111.09 113.39 25.89 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.789 0.328 . . . . 63.43 110.908 -179.963 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' M' M ' 27' ' ' LYS . . . . . . . . . . . . . 21.7 tptp -164.09 128.98 2.8 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.249 -0.432 . . . . 63.44 110.894 179.832 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' M' M ' 28' ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 -138.1 -74.51 0.4 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.242 -0.435 . . . . 74.33 110.902 179.965 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' M' M ' 29' ' ' TYR . . . . . 0.499 ' CE2' HG13 ' A' ' 55' ' ' VAL . 2.2 m-85 -65.22 -79.73 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.234 -0.439 . . . . 72.12 110.955 -179.886 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' M' M ' 30' ' ' LYS . . . . . . . . . . . . . 2.1 mtpp 176.17 -42.99 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.121 -0.491 . . . . 71.03 110.887 179.9 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' M' M ' 31' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -82.89 -21.16 34.34 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.209 -0.45 . . . . 71.24 110.902 179.93 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' M' M ' 32' ' ' LYS . . . . . 0.408 ' O ' HG23 ' M' ' 35' ' ' VAL . 25.1 ttpp -48.04 -48.61 32.99 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.198 -0.455 . . . . 73.21 110.93 179.813 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' M' M ' 33' ' ' HIS . . . . . . . . . . . . . 11.1 t-80 -52.01 -37.5 53.5 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.233 -0.439 . . . . 75.51 110.846 179.87 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' M' M ' 34' ' ' ILE . . . . . 0.413 ' CG2' HD12 ' A' ' 39' ' ' LEU . 36.3 mm -51.66 -37.19 19.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.184 -0.462 . . . . 73.15 111.108 -179.991 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' M' M ' 35' ' ' VAL . . . . . 0.408 HG23 ' O ' ' M' ' 32' ' ' LYS . 46.3 t -49.48 -38.45 12.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.207 -0.451 . . . . 73.13 111.126 179.862 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' M' M ' 36' ' ' TRP . . . . . . . . . . . . . 16.9 m0 -58.6 -39.52 80.63 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.19 -0.459 . . . . 74.1 110.919 179.999 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' M' M ' 37' ' ' ALA . . . . . 0.986 ' HB3' HD13 ' A' ' 39' ' ' LEU . . . -63.44 -18.7 64.02 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.193 -0.458 . . . . 34.22 111.096 179.905 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' M' M ' 38' ' ' SER . . . . . 0.492 ' HB3' HD23 ' A' ' 18' ' ' LEU . 1.1 m -70.62 -18.03 62.87 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.18 -0.464 . . . . 72.22 110.908 -179.798 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' M' M ' 39' ' ' ARG . . . . . . . . . . . . . 8.7 mmm180 -61.48 -25.14 67.05 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.118 -0.492 . . . . 75.04 110.92 -179.963 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' M' M ' 40' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -85.51 -47.97 9.4 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.143 -0.48 . . . . 74.23 110.851 -179.904 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' M' M ' 41' ' ' LEU . . . . . 0.632 HD21 ' OG ' ' A' ' 38' ' ' SER . 12.0 mt -60.77 157.31 15.15 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.191 -0.458 . . . . 74.03 110.882 -179.933 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' M' M ' 42' ' ' GLU . . . . . . . . . . . . . 17.5 mt-10 -141.09 26.83 2.0 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.169 -0.469 . . . . 75.23 110.865 179.945 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' M' M ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.326 0 CA-C-N 116.17 -0.468 . . . . 74.43 110.854 -179.903 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 241' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 262' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 301' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 322' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 35.4 tp60 . . . . . 0 C--O 1.232 0.133 0 CA-C-O 120.788 0.328 . . . . 74.299999999999997 110.898 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 69.3 mt -71.72 -37.44 62.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.209 -0.45 . . . . 74.209999999999994 111.133 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -52.18 -32.92 38.4 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.158 -0.474 . . . . 32.530000000000001 111.087 179.796 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 -74.82 -52.1 12.28 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.231 -0.441 . . . . 73.510000000000005 110.893 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.556 ' CB ' HD13 ' A' ' 69' ' ' LEU . 50.1 m-85 -58.34 -46.0 87.07 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.181 -0.463 . . . . 65.299999999999997 110.843 -179.901 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.0 ttpt -54.89 -29.57 56.11 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.124 -0.489 . . . . 74.5 110.929 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -71.18 -30.76 66.82 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.198 -0.456 . . . . 52.219999999999999 110.932 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -64.96 -42.61 94.45 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.157 -0.474 . . . . 64.340000000000003 111.107 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 48.5 t80 -55.41 -54.21 46.62 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.168 -0.469 . . . . 71.549999999999997 110.898 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 36.5 t -51.99 -36.64 50.4 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.112 -0.495 . . . . 64.340000000000003 110.871 -179.812 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 17.7 tp -59.73 -41.62 91.32 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.15 -0.477 . . . . 71.409999999999997 110.897 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.412 ' CD1' HG11 ' A' ' 35' ' ' VAL . 33.9 m-85 -82.59 -25.87 32.85 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.227 -0.442 . . . . 74.310000000000002 110.852 179.982 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 11.1 t0 -86.69 98.53 11.18 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.179 -0.464 . . . . 53.119999999999997 110.89 179.962 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 70.4 mmtt -72.57 -56.85 4.71 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.166 -0.47 . . . . 73.549999999999997 110.894 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 27.1 p-10 -72.84 -10.09 59.4 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.206 -0.452 . . . . 63.140000000000001 110.835 179.922 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 52.05 49.08 50.74 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.759 -0.734 . . . . 73.5 112.465 -179.935 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 31.1 p-10 -88.53 -15.62 34.76 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.855 0.359 . . . . 55.329999999999998 110.871 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 105.31 -11.68 47.69 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.748 -0.739 . . . . 73.400000000000006 112.521 -179.912 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 49.0 p -135.21 130.69 35.66 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.75 0.31 . . . . 64.530000000000001 111.146 -179.879 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 24.7 mt -88.14 126.44 41.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.206 -0.452 . . . . 62.0 111.109 179.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.681 HG22 ' CG2' ' A' ' 62' ' ' THR . 60.4 p -110.33 176.2 5.14 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.187 -0.46 . . . . 50.32 111.143 179.962 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 21.7 p -64.12 -32.88 74.61 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.242 -0.435 . . . . 71.230000000000004 111.128 -179.964 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 43.5 mtpt -69.72 -43.53 72.16 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.204 -0.453 . . . . 65.230000000000004 110.932 179.901 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -75.21 -33.74 61.42 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.224 -0.444 . . . . 75.120000000000005 110.903 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.1 tt -74.28 -54.9 6.73 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.132 -0.485 . . . . 74.409999999999997 110.918 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -52.17 -28.53 26.56 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.739 -0.743 . . . . 73.400000000000006 112.467 179.91 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 94.9 m -70.84 -54.83 10.12 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.865 0.364 . . . . 72.439999999999998 111.17 -179.864 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.412 HG11 ' CD1' ' A' ' 19' ' ' PHE . 97.6 t -56.39 -46.67 82.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.171 -0.468 . . . . 75.209999999999994 111.122 179.9 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 31.3 mtp -55.96 -31.57 63.09 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.171 -0.468 . . . . 63.100000000000001 110.838 179.946 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 12.6 tpt180 -59.83 -53.32 59.28 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.265 -0.425 . . . . 73.0 110.863 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . 0.578 ' OG ' HD21 ' M' ' 41' ' ' LEU . 2.2 t -61.87 -26.6 68.24 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.185 -0.462 . . . . 71.319999999999993 110.869 -179.775 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 1.01 HD13 ' HB3' ' M' ' 37' ' ' ALA . 53.8 mt -77.96 -24.62 48.08 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.126 -0.488 . . . . 53.130000000000003 110.948 179.962 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 100.84 33.08 5.13 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.755 -0.736 . . . . 40.520000000000003 112.451 179.88 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 5.0 tp-100 -130.86 105.82 8.02 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.805 0.336 . . . . 72.340000000000003 110.877 -179.902 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 59.1 t30 -109.92 76.75 1.0 Allowed Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.643 0.735 . . . . 54.439999999999998 110.923 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.75 167.97 22.9 Favored 'Trans proline' 0 C--O 1.232 0.186 0 C-N-CA 122.685 2.256 . . . . 74.209999999999994 112.359 179.933 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 69.7 p -81.62 159.95 23.9 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.199 -0.455 . . . . 63.240000000000002 111.179 -179.986 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -52.06 -40.45 61.17 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.253 -0.431 . . . . 71.140000000000001 110.858 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.17 -31.48 64.25 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.194 -0.457 . . . . 75.319999999999993 111.081 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 27.1 tt0 -69.73 -45.94 67.01 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.223 -0.444 . . . . 73.040000000000006 110.891 -179.936 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 29.2 mt -55.33 -51.61 66.18 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.152 -0.476 . . . . 60.350000000000001 110.919 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 14.7 tp60 -59.7 -28.98 67.78 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.183 -0.462 . . . . 73.329999999999998 110.885 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -70.28 -49.57 48.41 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.224 -0.443 . . . . 75.299999999999997 110.871 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . 0.435 ' HE2' ' HG3' ' M' ' 30' ' ' LYS . 7.5 mtp -55.46 -52.65 62.92 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.204 -0.453 . . . . 75.310000000000002 110.863 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 62.8 mt -64.4 -37.72 80.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.257 -0.429 . . . . 63.409999999999997 111.128 179.941 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 19.4 m-20 -57.28 -41.74 80.35 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.195 -0.457 . . . . 73.319999999999993 110.912 179.907 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 16.3 mm-40 -53.13 -52.75 57.69 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.167 -0.469 . . . . 74.109999999999999 110.92 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 16.5 m -76.02 -19.26 15.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.155 -0.475 . . . . 75.049999999999997 111.126 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 38.8 t0 -66.86 95.98 0.39 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.165 -0.47 . . . . 45.420000000000002 110.856 179.931 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.21 -42.0 12.59 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.125 -0.488 . . . . 74.340000000000003 111.091 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -82.2 -0.15 43.76 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.245 -0.434 . . . . 62.539999999999999 110.864 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 53.62 60.86 7.67 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.763 -0.732 . . . . 71.329999999999998 112.489 -179.933 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 52.3 p-10 -114.49 -15.81 12.0 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.876 0.37 . . . . 73.150000000000006 110.889 -179.893 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 89.59 19.65 47.69 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.773 -0.727 . . . . 63.420000000000002 112.513 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . 0.681 ' CG2' HG22 ' A' ' 28' ' ' THR . 33.4 p -152.07 156.78 40.59 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.763 0.316 . . . . 62.439999999999998 111.148 -179.829 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.498 ' CD1' HD21 ' M' ' 31' ' ' LEU . 18.4 mt -93.37 111.04 24.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.209 -0.451 . . . . 74.430000000000007 111.123 179.921 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -75.72 -172.91 2.03 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.154 -0.475 . . . . 73.230000000000004 110.842 179.862 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.53 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 2.4 t80 -65.43 -58.28 12.42 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.633 0.73 . . . . 60.229999999999997 110.849 -179.855 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . 0.53 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 54.0 Cg_endo -69.7 -26.84 27.46 Favored 'Trans proline' 0 C--N 1.342 0.201 0 C-N-CA 122.64 2.227 . . . . 62.32 112.385 179.987 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 22.9 mt-10 -62.59 -39.99 95.49 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.21 -0.45 . . . . 72.439999999999998 110.872 -179.976 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 13.2 t80 -74.71 -35.71 62.7 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.14 -0.482 . . . . 72.420000000000002 110.882 -179.896 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.556 HD13 ' CB ' ' A' ' 12' ' ' PHE . 39.8 tp -70.56 -54.2 13.03 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.16 -0.473 . . . . 61.149999999999999 110.896 180.0 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 14.2 t -51.63 -30.4 21.31 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.165 -0.47 . . . . 71.540000000000006 111.176 179.938 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 37.3 ttp -59.71 -49.94 75.79 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.194 -0.457 . . . . 60.210000000000001 110.899 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . 0.496 ' HE2' HG21 ' M' ' 35' ' ' VAL . 3.1 mmt -70.83 -25.81 63.01 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.184 -0.462 . . . . 71.420000000000002 110.872 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.278 0 CA-C-N 116.212 -0.449 . . . . 55.140000000000001 111.132 179.902 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.597 HD13 HG13 ' A' ' 142' ' ' VAL . 65.3 mt . . . . . 0 C--O 1.232 0.147 0 CA-C-O 120.828 0.346 . . . . 64.430000000000007 111.142 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 34.2 ttt-85 -71.24 -45.41 63.33 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.195 -0.457 . . . . 71.299999999999997 110.841 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.729 ' O ' HG23 ' A' ' 91' ' ' VAL . 10.2 tp10 -60.65 -53.77 53.38 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.222 -0.445 . . . . 74.420000000000002 110.893 -179.906 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -53.45 -47.85 69.34 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.183 -0.462 . . . . 22.120000000000001 111.088 179.896 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 3.0 t80 -52.09 -46.87 65.41 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.22 -0.446 . . . . 73.109999999999999 110.865 -179.899 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 22.5 ttm-85 -69.07 -31.71 70.66 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.154 -0.475 . . . . 71.439999999999998 110.863 -179.919 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . 0.729 HG23 ' O ' ' A' ' 87' ' ' GLU . 92.5 t -68.92 -27.34 35.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.163 -0.471 . . . . 74.519999999999996 111.121 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 17.9 m-85 -96.35 -26.59 15.31 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.183 -0.462 . . . . 73.129999999999995 110.899 179.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 29.6 t0 -69.48 94.57 0.76 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.141 -0.481 . . . . 71.530000000000001 110.913 179.922 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 9.7 ttmm -78.47 -52.82 7.97 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.223 -0.444 . . . . 74.25 110.895 -179.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 50.3 p30 -72.52 -9.14 58.2 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.176 -0.466 . . . . 71.129999999999995 110.789 179.938 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 60.17 27.64 65.43 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.77 -0.729 . . . . 75.219999999999999 112.464 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 39.6 p-10 -82.85 -16.22 48.5 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.879 0.371 . . . . 72.329999999999998 110.901 -179.942 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 86.47 18.67 58.35 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.748 -0.739 . . . . 70.349999999999994 112.473 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 12.4 m-85 -140.47 145.37 36.85 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.852 0.358 . . . . 72.420000000000002 110.929 -179.819 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 66.7 mt -111.5 127.02 68.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.119 -0.492 . . . . 75.310000000000002 111.13 179.93 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 26.4 p -117.0 174.67 5.97 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.155 -0.475 . . . . 62.210000000000001 110.853 -179.893 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -60.03 -30.02 68.9 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.15 -0.477 . . . . 61.539999999999999 111.113 179.912 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -69.93 -46.12 66.03 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.215 -0.448 . . . . 63.43 111.089 179.931 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 55.5 mt-10 -72.5 -46.61 53.89 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.218 -0.446 . . . . 74.420000000000002 110.881 -179.893 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.596 HD21 ' HE2' ' A' ' 124' ' ' MET . 44.1 tp -55.84 -46.54 78.15 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.187 -0.461 . . . . 74.120000000000005 110.951 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . 0.671 ' HB2' HG21 ' A' ' 121' ' ' VAL . 56.8 ttp85 -58.31 -33.76 69.84 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.168 -0.469 . . . . 71.439999999999998 110.9 179.886 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 79.6 t60 -72.18 -36.4 69.25 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.176 -0.465 . . . . 73.5 110.836 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 83.8 t -66.78 -40.82 86.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.2 -0.454 . . . . 74.200000000000003 111.124 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' MET . . . . . 0.651 ' HE2' HD11 ' M' ' 19' ' ' ILE . 11.2 mmt -64.15 -27.9 69.39 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.183 -0.462 . . . . 73.430000000000007 110.883 179.91 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 1.5 m -66.08 -42.0 89.95 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.244 -0.435 . . . . 75.099999999999994 111.145 -179.923 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 33.4 t30 -58.63 -34.3 71.02 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.283 -0.417 . . . . 70.439999999999998 110.922 179.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 18.0 mt -73.25 -26.22 61.02 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.158 -0.474 . . . . 72.439999999999998 110.918 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 100.48 31.1 5.94 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.723 -0.751 . . . . 54.240000000000002 112.508 179.929 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -108.73 114.68 28.67 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.903 0.382 . . . . 74.310000000000002 110.88 -179.855 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.4 102.03 2.09 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.116 -0.493 . . . . 73.340000000000003 110.899 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.477 HD12 ' CB ' ' A' ' 109' ' ' MET . 11.1 mt -133.21 146.81 51.82 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.215 -0.448 . . . . 62.32 110.894 179.948 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . 0.541 ' O ' HG23 ' A' ' 121' ' ' VAL . 29.2 p -108.51 -175.39 2.76 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.141 -0.481 . . . . 63.039999999999999 111.115 179.949 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 72.6 m-20 -65.57 -38.91 90.92 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.169 -0.468 . . . . 73.239999999999995 110.878 179.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -65.43 -33.47 76.03 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.176 -0.465 . . . . 73.109999999999999 110.93 -179.929 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 19.0 tt0 -72.11 -49.8 33.28 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.12 -0.491 . . . . 72.530000000000001 110.905 -179.909 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.671 HG21 ' HB2' ' A' ' 106' ' ' ARG . 58.3 t -54.45 -31.16 22.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.175 -0.466 . . . . 71.219999999999999 111.131 179.937 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -51.94 -42.7 63.04 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.193 -0.458 . . . . 52.219999999999999 110.879 179.948 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 11.4 tp10 -62.94 -31.4 72.48 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.164 -0.471 . . . . 74.430000000000007 110.905 -179.909 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . 0.596 ' HE2' HD21 ' A' ' 105' ' ' LEU . 94.8 mtp -72.99 -59.47 2.69 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.098 -0.501 . . . . 74.310000000000002 110.869 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 35.9 mm -53.99 -35.59 28.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.208 -0.451 . . . . 73.439999999999998 111.146 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 39.1 ttt85 -63.33 -31.9 73.18 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.199 -0.455 . . . . 73.140000000000001 110.898 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 19.3 tp10 -74.85 -52.37 11.52 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.137 -0.483 . . . . 74.409999999999997 110.871 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.653 ' HB3' HG22 ' A' ' 136' ' ' VAL . . . -65.11 -34.43 78.38 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.185 -0.461 . . . . 35.240000000000002 111.102 179.967 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 49.4 t0 -68.4 86.77 0.29 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.167 -0.47 . . . . 75.099999999999994 110.862 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 58.0 mt -79.83 -46.23 22.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.184 -0.462 . . . . 73.219999999999999 111.085 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 21.2 p30 -72.76 -8.67 56.58 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.176 -0.465 . . . . 62.450000000000003 110.84 179.89 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 62.71 42.99 99.61 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.745 -0.741 . . . . 54.140000000000001 112.5 -179.914 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 34.8 p-10 -88.08 -15.95 34.86 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.881 0.372 . . . . 75.140000000000001 110.89 -179.976 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 104.1 2.36 45.16 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.733 -0.746 . . . . 60.049999999999997 112.496 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 5.6 tt0 -149.19 172.24 15.15 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.858 0.361 . . . . 73.439999999999998 110.906 -179.85 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 136' ' ' VAL . . . . . 0.653 HG22 ' HB3' ' A' ' 128' ' ' ALA . 94.6 t -107.51 111.31 35.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.233 -0.44 . . . . 72.219999999999999 111.125 179.935 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 44.0 p-10 -92.5 166.13 12.68 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.136 -0.484 . . . . 44.219999999999999 110.934 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 138' ' ' TYR . . . . . 0.609 ' O ' HG23 ' A' ' 142' ' ' VAL . 78.1 t80 -51.96 -46.72 64.89 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.203 -0.453 . . . . 75.129999999999995 110.961 -179.93 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -51.98 -41.04 61.84 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.092 -0.504 . . . . 75.349999999999994 110.913 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -78.44 -36.26 45.7 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.14 -0.482 . . . . 75.140000000000001 110.873 -179.92 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 66.0 t80 -64.67 -35.51 81.27 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.136 -0.484 . . . . 51.240000000000002 110.87 -179.938 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . 0.609 HG23 ' O ' ' A' ' 138' ' ' TYR . 94.4 t -69.77 -38.5 76.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.169 -0.468 . . . . 64.140000000000001 111.094 -179.982 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 45.0 tt0 -71.37 -36.56 71.49 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.19 -0.459 . . . . 73.200000000000003 110.926 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 5.7 tpt -72.81 -29.16 63.03 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.194 -0.457 . . . . 73.310000000000002 110.881 179.969 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -84.32 -27.91 27.45 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.24 -0.436 . . . . 74.049999999999997 110.846 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 87.6 m . . . . . 0 C--N 1.329 -0.284 0 CA-C-N 116.231 -0.44 . . . . 63.219999999999999 111.108 -179.898 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' M' M ' 15' ' ' LYS . . . . . . . . . . . . . 20.0 mttm . . . . . 0 C--O 1.231 0.126 0 CA-C-O 120.735 0.302 . . . . 74.430000000000007 110.871 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' M' M ' 16' ' ' TRP . . . . . 0.623 ' CE3' HD12 ' M' ' 19' ' ' ILE . 7.2 m95 -52.1 -45.9 65.05 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.257 -0.429 . . . . 75.450000000000003 110.931 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' M' M ' 17' ' ' GLU . . . . . . . . . . . . . 15.8 tm-20 -57.52 -27.2 62.38 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.211 -0.449 . . . . 71.25 110.897 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' M' M ' 18' ' ' LYS . . . . . . . . . . . . . 8.9 ttmm -69.93 -27.6 64.9 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.158 -0.473 . . . . 74.510000000000005 110.859 179.989 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' M' M ' 19' ' ' ILE . . . . . 0.651 HD11 ' HE2' ' A' ' 109' ' ' MET . 34.3 mt -83.09 -25.22 8.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.245 -0.434 . . . . 64.209999999999994 111.146 179.863 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' M' M ' 20' ' ' ARG . . . . . . . . . . . . . 22.7 ttp180 . . . . . 0 C--N 1.329 -0.311 0 CA-C-N 116.171 -0.468 . . . . 75.329999999999998 110.853 179.967 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' M' M ' 30' ' ' LYS . . . . . 0.435 ' HG3' ' HE2' ' A' ' 51' ' ' MET . 17.8 tptt . . . . . 0 C--O 1.232 0.147 0 CA-C-O 120.871 0.367 . . . . 72.329999999999998 110.946 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' M' M ' 31' ' ' LEU . . . . . 0.498 HD21 ' CD1' ' A' ' 63' ' ' ILE . 18.9 tp -179.76 -39.07 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.212 -0.449 . . . . 73.310000000000002 110.896 179.912 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' M' M ' 32' ' ' LYS . . . . . . . . . . . . . 1.6 tmtt? -50.26 -40.95 49.52 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.23 -0.441 . . . . 74.409999999999997 110.907 179.849 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' M' M ' 33' ' ' HIS . . . . . . . . . . . . . 83.9 t60 -50.25 -38.68 41.99 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.23 -0.441 . . . . 51.509999999999998 110.894 179.842 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' M' M ' 34' ' ' ILE . . . . . . . . . . . . . 48.8 mm -50.13 -39.77 16.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.2 -0.455 . . . . 71.109999999999999 111.102 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' M' M ' 35' ' ' VAL . . . . . 0.496 HG21 ' HE2' ' A' ' 72' ' ' MET . 97.0 t -49.16 -40.18 13.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.228 -0.442 . . . . 74.120000000000005 111.1 179.869 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' M' M ' 36' ' ' TRP . . . . . . . . . . . . . 24.7 m0 -58.57 -39.67 80.98 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.196 -0.456 . . . . 73.299999999999997 110.906 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' M' M ' 37' ' ' ALA . . . . . 1.01 ' HB3' HD13 ' A' ' 39' ' ' LEU . . . -63.99 -18.69 64.54 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.25 -0.432 . . . . 72.319999999999993 111.095 179.864 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' M' M ' 38' ' ' SER . . . . . . . . . . . . . 1.6 m -71.94 -17.93 62.05 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.278 -0.419 . . . . 64.010000000000005 110.876 -179.808 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' M' M ' 39' ' ' ARG . . . . . . . . . . . . . 3.5 tpt180 -57.56 -25.43 59.96 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.122 -0.49 . . . . 62.420000000000002 110.885 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' M' M ' 40' ' ' GLU . . . . . . . . . . . . . 12.4 mt-10 -85.94 -48.12 9.0 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.182 -0.463 . . . . 75.329999999999998 110.897 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' M' M ' 41' ' ' LEU . . . . . 0.578 HD21 ' OG ' ' A' ' 38' ' ' SER . 9.8 mt . . . . . 0 C--N 1.328 -0.33 0 CA-C-N 116.153 -0.476 . . . . 73.219999999999999 110.919 -179.941 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 16.5 tp60 . . . . . 0 C--O 1.232 0.149 0 CA-C-O 120.761 0.315 . . . . 74.129999999999995 110.873 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 72.0 mt -65.45 -47.25 87.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.201 -0.454 . . . . 75.510000000000005 111.112 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -56.23 -26.48 51.47 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.162 -0.472 . . . . 53.200000000000003 111.097 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -71.43 -44.31 65.11 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.227 -0.442 . . . . 62.130000000000003 110.882 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 26.1 m-85 -75.78 -45.9 33.69 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.207 -0.451 . . . . 73.439999999999998 110.876 -179.941 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 25.6 ttmt -55.47 -26.09 40.46 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.176 -0.466 . . . . 62.520000000000003 110.871 179.998 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 16.4 mm-40 -71.91 -40.25 68.97 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.24 -0.436 . . . . 71.340000000000003 110.889 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -60.1 -39.21 85.36 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.14 -0.482 . . . . 72.140000000000001 111.123 179.907 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 54.7 t80 -53.04 -52.02 59.86 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.193 -0.458 . . . . 75.439999999999998 110.909 -179.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 6.1 t -54.59 -30.37 54.32 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.171 -0.468 . . . . 74.150000000000006 110.852 -179.797 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.571 HD23 ' HB3' ' M' ' 38' ' ' SER . 15.5 tp -66.36 -45.04 81.49 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.089 -0.505 . . . . 74.219999999999999 110.929 179.991 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 57.3 m-85 -75.2 -26.21 58.81 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.235 -0.439 . . . . 72.200000000000003 110.896 179.898 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 12.9 t0 -78.27 98.56 5.95 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.108 -0.496 . . . . 61.340000000000003 110.884 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 1.3 tppp? -68.23 -51.97 39.33 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.178 -0.465 . . . . 54.340000000000003 110.894 -179.989 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 23.5 p-10 -79.51 -10.07 59.73 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.225 -0.443 . . . . 63.43 110.815 179.933 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 52.11 42.35 54.83 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.771 -0.728 . . . . 50.020000000000003 112.468 -179.938 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 19.6 p-10 -88.73 -15.69 34.12 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.896 0.379 . . . . 54.409999999999997 110.871 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 104.64 16.72 16.74 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.758 -0.734 . . . . 32.240000000000002 112.524 -179.955 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -154.64 130.71 10.25 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.76 0.314 . . . . 75.530000000000001 111.13 -179.834 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 29.3 mt -89.18 123.77 41.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.252 -0.431 . . . . 62.340000000000003 111.108 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.521 ' HA ' HG22 ' A' ' 62' ' ' THR . 43.5 p -98.58 -177.36 3.65 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.148 -0.478 . . . . 75.239999999999995 111.151 179.954 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.85 HG22 HD12 ' A' ' 52' ' ' ILE . 49.4 p -71.5 -39.56 70.75 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.235 -0.439 . . . . 74.140000000000001 111.171 -179.998 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 45.2 mmtt -68.9 -50.09 52.57 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.192 -0.458 . . . . 75.450000000000003 110.881 179.906 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.607 ' O ' HG23 ' A' ' 35' ' ' VAL . 32.8 mt-10 -59.19 -38.91 80.99 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.219 -0.446 . . . . 64.0 110.896 179.98 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.2 tt -74.3 -56.2 5.15 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.16 -0.473 . . . . 75.010000000000005 110.921 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -52.26 -44.42 57.83 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.748 -0.739 . . . . 74.140000000000001 112.46 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 92.4 m -56.49 -47.25 79.65 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.831 0.348 . . . . 65.019999999999996 111.165 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.607 HG23 ' O ' ' A' ' 31' ' ' GLU . 97.0 t -62.78 -51.11 76.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.197 -0.456 . . . . 73.040000000000006 111.13 179.937 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 21.4 mtp -51.91 -33.87 38.93 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.185 -0.461 . . . . 70.340000000000003 110.891 179.87 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 59.0 ttt85 -57.07 -54.59 45.01 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.271 -0.422 . . . . 70.219999999999999 110.906 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . 0.653 ' OG ' HD21 ' M' ' 41' ' ' LEU . 1.7 t -60.98 -26.22 67.41 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.196 -0.456 . . . . 41.130000000000003 110.879 -179.836 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.992 HD13 ' HB3' ' M' ' 37' ' ' ALA . 69.7 mt -79.73 -18.91 50.04 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.137 -0.483 . . . . 62.329999999999998 110.904 179.972 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 101.55 28.85 6.51 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.753 -0.737 . . . . 71.400000000000006 112.519 179.931 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 2.9 tt0 -128.69 106.5 8.98 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.776 0.322 . . . . 72.409999999999997 110.901 -179.84 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 6.0 t-20 -109.86 76.9 1.0 Allowed Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.625 0.726 . . . . 71.239999999999995 110.868 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.72 158.99 55.11 Favored 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.711 2.274 . . . . 53.219999999999999 112.361 179.903 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 66.4 p -76.61 160.19 29.63 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.217 -0.447 . . . . 73.510000000000005 111.159 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 7.9 mt-10 -51.97 -39.52 59.45 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.172 -0.467 . . . . 73.140000000000001 110.933 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.26 -31.57 64.17 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.126 -0.488 . . . . 72.540000000000006 111.111 179.895 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 59.8 tt0 -69.71 -47.94 61.33 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.187 -0.461 . . . . 72.549999999999997 110.919 -179.941 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 29.3 mt -55.34 -51.84 65.47 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.126 -0.488 . . . . 74.340000000000003 110.892 -179.961 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 41.4 tp60 -60.05 -28.99 68.23 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.255 -0.43 . . . . 51.049999999999997 110.955 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 39.3 t0 -67.13 -46.61 73.59 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.161 -0.472 . . . . 63.420000000000002 110.853 179.926 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . 0.583 ' HB3' HD22 ' M' ' 31' ' ' LEU . 10.9 mtp -58.72 -58.03 10.37 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.215 -0.448 . . . . 71.510000000000005 110.872 179.99 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.85 HD12 HG22 ' A' ' 29' ' ' THR . 74.1 mt -56.53 -37.56 52.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.224 -0.444 . . . . 74.420000000000002 111.148 179.976 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 63.9 m-20 -69.74 -34.63 74.11 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.17 -0.468 . . . . 64.299999999999997 110.883 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 25.5 mt-10 -61.57 -30.92 70.97 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.168 -0.469 . . . . 71.25 110.912 179.973 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 6.5 m -109.17 17.99 6.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.144 -0.48 . . . . 70.510000000000005 111.121 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 32.3 t0 -90.11 97.25 11.08 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.176 -0.466 . . . . 72.450000000000003 110.865 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.13 -45.32 10.23 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.151 -0.477 . . . . 72.409999999999997 111.09 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 19.8 p-10 -81.85 -0.09 41.94 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.256 -0.429 . . . . 72.120000000000005 110.86 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 54.35 57.31 17.65 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.736 -0.745 . . . . 74.140000000000001 112.484 -179.943 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 48.3 p-10 -114.48 -15.71 12.01 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.877 0.37 . . . . 45.509999999999998 110.902 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 90.28 21.94 36.57 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.773 -0.727 . . . . 63.130000000000003 112.489 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . 0.521 HG22 ' HA ' ' A' ' 28' ' ' THR . 76.0 p -150.94 165.07 34.82 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.731 0.301 . . . . 54.140000000000001 111.119 -179.86 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 28.0 mt -94.61 114.44 31.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.187 -0.461 . . . . 73.430000000000007 111.099 179.891 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -78.41 -172.91 3.07 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.168 -0.469 . . . . 72.310000000000002 110.871 179.838 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.532 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 2.5 t80 -63.97 -58.4 14.75 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-O 121.672 0.748 . . . . 63.140000000000001 110.895 -179.902 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . 0.532 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 53.8 Cg_endo -69.7 -32.08 19.54 Favored 'Trans proline' 0 C--N 1.341 0.136 0 C-N-CA 122.724 2.283 . . . . 63.340000000000003 112.387 179.985 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 74.1 mt-10 -57.25 -42.67 81.94 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.166 -0.47 . . . . 63.43 110.907 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 78.7 t80 -70.83 -36.45 72.92 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.13 -0.486 . . . . 71.400000000000006 110.9 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 15.4 tp -67.53 -53.7 26.26 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.136 -0.484 . . . . 74.530000000000001 110.973 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 14.9 t -57.24 -29.43 63.78 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.16 -0.473 . . . . 74.150000000000006 111.185 179.899 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 45.8 ttp -61.15 -42.32 98.35 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.176 -0.466 . . . . 71.329999999999998 110.898 179.901 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 8.8 mtt -79.78 -45.91 17.95 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.217 -0.447 . . . . 72.140000000000001 110.918 179.939 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.317 0 CA-C-N 116.215 -0.448 . . . . 74.109999999999999 111.086 179.886 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.62 ' CG2' HG22 ' A' ' 142' ' ' VAL . 57.8 mt . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.799 0.333 . . . . 73.329999999999998 111.091 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 46.3 ttp180 -71.65 -28.22 63.61 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.181 -0.463 . . . . 74.239999999999995 110.897 179.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.681 ' O ' HG23 ' A' ' 91' ' ' VAL . 4.1 tp10 -71.89 -29.14 64.03 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.164 -0.471 . . . . 71.519999999999996 110.888 -179.914 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . 0.467 ' HB1' ' CE2' ' A' ' 92' ' ' PHE . . . -76.35 -35.64 58.62 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.14 -0.482 . . . . 63.409999999999997 111.096 179.949 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 3.9 t80 -56.82 -49.31 75.79 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.196 -0.456 . . . . 74.030000000000001 110.863 -179.904 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 10.5 ptm180 -62.82 -26.16 68.6 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.102 -0.499 . . . . 71.329999999999998 110.888 -179.886 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . 0.681 HG23 ' O ' ' A' ' 87' ' ' GLU . 91.8 t -74.0 -45.74 47.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.201 -0.454 . . . . 75.209999999999994 111.156 179.951 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.467 ' CE2' ' HB1' ' A' ' 88' ' ' ALA . 9.5 m-85 -75.54 -34.76 60.78 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.126 -0.488 . . . . 74.140000000000001 110.864 -179.993 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 28.5 t0 -64.52 93.05 0.09 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.175 -0.466 . . . . 63.409999999999997 110.867 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 1.5 ttmp? -78.71 -52.75 7.96 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.175 -0.466 . . . . 65.209999999999994 110.883 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 54.1 p-10 -72.71 -9.08 58.21 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.201 -0.454 . . . . 43.200000000000003 110.854 179.911 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 60.97 33.53 84.21 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.759 -0.734 . . . . 54.200000000000003 112.517 -179.943 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 40.7 p-10 -85.52 -16.22 40.22 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.876 0.37 . . . . 72.099999999999994 110.896 -179.9 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 85.87 18.63 59.37 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.732 -0.747 . . . . 60.549999999999997 112.497 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 14.5 m-85 -140.75 151.01 44.11 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.833 0.349 . . . . 53.039999999999999 110.947 -179.799 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 64.0 mt -115.82 127.24 73.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.144 -0.48 . . . . 63.009999999999998 111.172 179.877 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 89.4 p -116.62 -171.47 2.02 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.186 -0.461 . . . . 61.119999999999997 110.836 -179.87 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -68.61 -44.77 73.58 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.133 -0.485 . . . . 70.299999999999997 111.085 179.947 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -63.8 -38.01 89.51 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.223 -0.444 . . . . 62.509999999999998 111.063 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 23.6 mt-10 -76.04 -52.07 10.96 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.216 -0.447 . . . . 74.200000000000003 110.858 -179.889 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.667 HD21 ' HG2' ' A' ' 124' ' ' MET . 35.2 tp -53.37 -52.42 59.31 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.192 -0.458 . . . . 70.0 110.952 179.998 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 50.8 ttt180 -52.27 -43.48 64.41 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.187 -0.46 . . . . 75.120000000000005 110.883 179.934 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 77.6 t60 -54.27 -34.43 60.81 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.147 -0.478 . . . . 74.230000000000004 110.893 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 92.8 t -70.25 -48.28 62.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.18 -0.463 . . . . 74.230000000000004 111.133 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' MET . . . . . 0.614 ' HG2' HD11 ' A' ' 116' ' ' LEU . 0.2 OUTLIER -64.4 -28.23 69.54 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.186 -0.461 . . . . 71.239999999999995 110.877 179.885 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 15.6 m -62.53 -30.95 71.66 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.238 -0.437 . . . . 70.219999999999999 111.145 -179.936 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -74.71 -25.34 59.06 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.258 -0.428 . . . . 72.430000000000007 110.899 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -70.63 -25.68 63.14 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.137 -0.483 . . . . 64.129999999999995 110.948 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 99.62 19.77 19.22 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.747 -0.739 . . . . 61.200000000000003 112.466 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -103.44 112.86 25.96 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.961 0.41 . . . . 72.409999999999997 110.862 -179.845 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 16.2 mtpp -65.07 124.59 22.51 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.167 -0.47 . . . . 74.140000000000001 110.86 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.614 HD11 ' HG2' ' A' ' 109' ' ' MET . 5.2 mt -138.65 160.51 39.46 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.234 -0.439 . . . . 75.319999999999993 110.883 179.909 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 34.5 p -118.87 167.61 11.55 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.161 -0.472 . . . . 63.439999999999998 111.113 179.976 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 51.8 m-20 -52.34 -35.83 51.9 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.24 -0.437 . . . . 75.200000000000003 110.882 179.915 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 84.4 tt0 -72.81 -35.34 67.31 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.18 -0.464 . . . . 64.400000000000006 110.916 -179.92 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 36.2 tp10 -64.8 -44.54 89.59 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.138 -0.483 . . . . 63.130000000000003 110.872 -179.919 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 58.3 t -57.44 -40.46 74.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.159 -0.473 . . . . 70.010000000000005 111.092 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -52.2 -49.82 63.13 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.235 -0.439 . . . . 64.219999999999999 110.83 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 15.7 tp10 -55.8 -29.43 59.71 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.21 -0.45 . . . . 74.430000000000007 110.93 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . 0.667 ' HG2' HD21 ' A' ' 105' ' ' LEU . 2.9 ttt -72.65 -59.87 2.51 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.149 -0.478 . . . . 65.349999999999994 110.876 -179.973 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.49 HG23 HG23 ' A' ' 136' ' ' VAL . 33.7 mm -54.25 -35.72 30.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.229 -0.441 . . . . 75.439999999999998 111.129 179.943 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 40.8 ttt180 -63.41 -31.79 73.04 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.172 -0.467 . . . . 75.239999999999995 110.869 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 12.2 tm-20 -72.85 -50.65 22.67 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.169 -0.469 . . . . 74.329999999999998 110.932 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.562 ' HB3' ' CG2' ' A' ' 136' ' ' VAL . . . -69.68 -26.83 64.56 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.145 -0.48 . . . . 44.549999999999997 111.091 179.96 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 51.2 t0 -75.04 86.49 2.34 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.241 -0.436 . . . . 73.049999999999997 110.853 179.953 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 130' ' ' ILE . . . . . 0.775 HD12 ' HG2' ' A' ' 140' ' ' GLU . 4.9 mt -79.89 -45.19 22.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.215 -0.448 . . . . 72.019999999999996 111.139 179.972 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 18.2 p30 -72.42 -8.9 57.46 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.206 -0.452 . . . . 60.299999999999997 110.853 179.843 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 62.64 43.95 98.24 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.705 -0.759 . . . . 64.540000000000006 112.455 -179.927 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 33.7 p-10 -89.56 -15.96 31.71 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.858 0.361 . . . . 73.150000000000006 110.839 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 101.63 3.86 52.62 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.719 -0.753 . . . . 44.039999999999999 112.526 -179.931 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 4.7 tt0 -149.2 172.23 15.17 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.796 0.332 . . . . 73.120000000000005 110.918 -179.863 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 136' ' ' VAL . . . . . 0.562 ' CG2' ' HB3' ' A' ' 128' ' ' ALA . 95.9 t -114.08 111.49 36.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.197 -0.456 . . . . 65.150000000000006 111.131 179.934 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 14.7 p30 -91.46 170.96 9.53 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.215 -0.448 . . . . 74.150000000000006 110.909 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 45.5 t80 -55.01 -47.37 74.76 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.141 -0.481 . . . . 74.040000000000006 110.953 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -52.25 -50.62 61.7 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.112 -0.494 . . . . 72.040000000000006 110.879 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 140' ' ' GLU . . . . . 0.775 ' HG2' HD12 ' A' ' 130' ' ' ILE . 95.6 mt-10 -66.77 -31.72 72.55 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.152 -0.476 . . . . 64.230000000000004 110.885 -179.911 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 49.8 t80 -67.61 -50.18 59.4 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.147 -0.479 . . . . 74.200000000000003 110.861 -179.946 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . 0.62 HG22 ' CG2' ' A' ' 85' ' ' ILE . 73.0 t -62.79 -38.5 81.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.172 -0.467 . . . . 75.219999999999999 111.102 -179.973 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . 0.442 ' OE1' HD13 ' A' ' 130' ' ' ILE . 64.6 tt0 -57.46 -36.71 71.8 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.183 -0.462 . . . . 73.420000000000002 110.941 179.99 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 11.5 tpt -74.3 -55.47 5.98 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.182 -0.463 . . . . 74.329999999999998 110.896 179.938 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 21.0 ttm -59.42 -22.44 61.45 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.225 -0.443 . . . . 74.120000000000005 110.865 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 94.8 m . . . . . 0 C--N 1.33 -0.259 0 CA-C-N 116.249 -0.432 . . . . 71.150000000000006 111.167 -179.973 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' M' M ' 15' ' ' LYS . . . . . . . . . . . . . 4.3 mtmp? . . . . . 0 C--O 1.231 0.116 0 CA-C-O 120.757 0.313 . . . . 54.219999999999999 110.895 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' M' M ' 16' ' ' TRP . . . . . 0.48 ' CZ2' ' HB2' ' A' ' 128' ' ' ALA . 44.3 m95 -51.83 -30.12 22.14 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.233 -0.439 . . . . 61.439999999999998 110.92 179.891 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' M' M ' 17' ' ' GLU . . . . . . . . . . . . . 5.4 tm-20 -54.25 -39.32 66.72 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.983 0.42 . . . . 71.409999999999997 110.911 -179.984 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' M' M ' 18' ' ' LYS . . . . . . . . . . . . . 4.8 ttpm? -62.82 -23.44 67.27 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.12 -0.491 . . . . 72.049999999999997 110.887 179.93 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' M' M ' 19' ' ' ILE . . . . . . . . . . . . . 21.8 mm -70.89 -34.35 55.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.209 -0.45 . . . . 65.200000000000003 111.105 179.924 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' M' M ' 20' ' ' ARG . . . . . . . . . . . . . 25.4 ttm180 . . . . . 0 C--N 1.329 -0.326 0 CA-C-N 116.192 -0.458 . . . . 71.400000000000006 110.868 179.961 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' M' M ' 30' ' ' LYS . . . . . . . . . . . . . 8.1 pttm . . . . . 0 C--O 1.232 0.149 0 CA-C-O 120.815 0.34 . . . . 62.439999999999998 110.888 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' M' M ' 31' ' ' LEU . . . . . 0.583 HD22 ' HB3' ' A' ' 51' ' ' MET . 19.4 tp -121.92 -34.66 3.32 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.242 -0.435 . . . . 72.209999999999994 110.891 179.938 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' M' M ' 32' ' ' LYS . . . . . . . . . . . . . 4.8 pttm -51.31 -39.85 57.79 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.223 -0.444 . . . . 74.0 110.865 179.838 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' M' M ' 33' ' ' HIS . . . . . . . . . . . . . 10.4 t-160 -50.92 -36.74 40.02 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.245 -0.434 . . . . 74.239999999999995 110.848 179.91 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' M' M ' 34' ' ' ILE . . . . . . . . . . . . . 50.7 mm -50.16 -39.17 15.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.203 -0.453 . . . . 72.230000000000004 111.136 -179.961 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' M' M ' 35' ' ' VAL . . . . . . . . . . . . . 58.3 t -49.31 -39.76 13.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.161 -0.472 . . . . 74.409999999999997 111.144 179.836 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' M' M ' 36' ' ' TRP . . . . . . . . . . . . . 23.0 m0 -58.64 -39.36 80.32 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.141 -0.481 . . . . 64.239999999999995 110.931 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' M' M ' 37' ' ' ALA . . . . . 0.992 ' HB3' HD13 ' A' ' 39' ' ' LEU . . . -63.84 -18.65 64.36 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.23 -0.441 . . . . 74.239999999999995 111.05 179.935 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' M' M ' 38' ' ' SER . . . . . 0.571 ' HB3' HD23 ' A' ' 18' ' ' LEU . 0.7 OUTLIER -72.9 -18.06 61.45 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.229 -0.441 . . . . 75.439999999999998 110.853 -179.811 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' M' M ' 39' ' ' ARG . . . . . . . . . . . . . 20.0 ptt180 -57.69 -26.3 61.51 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.17 -0.468 . . . . 74.109999999999999 110.873 -179.899 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' M' M ' 40' ' ' GLU . . . . . . . . . . . . . 12.7 tp10 -85.86 -47.94 9.22 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.161 -0.472 . . . . 72.219999999999999 110.856 -179.914 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' M' M ' 41' ' ' LEU . . . . . 0.653 HD21 ' OG ' ' A' ' 38' ' ' SER . 13.3 mt . . . . . 0 C--N 1.328 -0.338 0 CA-C-N 116.163 -0.471 . . . . 73.030000000000001 110.866 -179.917 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 18.5 tt0 . . . . . 0 C--O 1.232 0.157 0 CA-C-O 120.801 0.334 . . . . 60.310000000000002 110.883 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 60.5 mt -65.56 -37.12 79.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.242 -0.435 . . . . 65.439999999999998 111.167 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -54.6 -51.83 64.1 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.176 -0.465 . . . . 72.319999999999993 111.126 179.784 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -62.34 -49.2 76.52 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.174 -0.466 . . . . 72.5 110.918 -179.959 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.534 ' HB3' HD13 ' A' ' 69' ' ' LEU . 14.2 m-85 -55.85 -45.82 78.34 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.155 -0.475 . . . . 63.530000000000001 110.849 -179.941 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 26.6 ttpt -55.46 -25.95 39.47 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.163 -0.472 . . . . 64.140000000000001 110.927 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 16.2 tt0 -75.11 -31.07 61.05 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.178 -0.465 . . . . 75.430000000000007 110.856 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -70.67 -33.41 70.91 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.14 -0.482 . . . . 61.020000000000003 111.096 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 93.9 t80 -75.56 -54.21 7.37 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.232 -0.44 . . . . 65.310000000000002 110.886 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 17.4 t -53.23 -29.56 33.21 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.134 -0.485 . . . . 52.43 110.888 -179.827 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.42 HD23 ' CB ' ' M' ' 38' ' ' SER . 16.1 tp -63.58 -41.82 98.33 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.114 -0.494 . . . . 73.129999999999995 110.873 -179.954 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.695 ' CD1' HG11 ' A' ' 35' ' ' VAL . 20.1 m-85 -77.55 -30.9 52.95 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.194 -0.457 . . . . 72.040000000000006 110.9 179.96 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 13.3 t0 -76.96 98.62 4.99 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.124 -0.489 . . . . 73.420000000000002 110.877 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 6.2 tptt -66.47 -49.93 64.99 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.186 -0.461 . . . . 72.25 110.938 179.948 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 24.7 p-10 -81.87 -10.2 59.38 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.237 -0.438 . . . . 75.030000000000001 110.852 179.878 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 51.59 44.84 54.33 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.773 -0.727 . . . . 73.310000000000002 112.427 -179.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 29.4 p-10 -88.32 -15.52 35.48 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.852 0.358 . . . . 74.230000000000004 110.897 179.989 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 105.45 -11.63 47.1 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.746 -0.74 . . . . 64.439999999999998 112.474 -179.943 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 32.8 p -130.4 130.6 44.55 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.734 0.302 . . . . 54.109999999999999 111.159 -179.831 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 24.2 mt -96.34 112.64 28.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.236 -0.438 . . . . 65.420000000000002 111.143 179.924 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.54 HG22 HG21 ' A' ' 62' ' ' THR . 21.0 p -95.57 175.52 6.52 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.199 -0.455 . . . . 63.119999999999997 111.162 179.932 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.637 HG22 HD12 ' A' ' 52' ' ' ILE . 60.4 p -60.35 -37.2 79.92 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.23 -0.441 . . . . 63.539999999999999 111.154 -179.988 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 19.9 mmmt -60.23 -50.11 74.95 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.209 -0.451 . . . . 74.439999999999998 110.932 179.857 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.672 ' O ' HG23 ' A' ' 35' ' ' VAL . 51.5 mt-10 -72.11 -32.73 67.25 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.213 -0.448 . . . . 64.200000000000003 110.876 179.986 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.535 ' O ' HD13 ' A' ' 32' ' ' LEU . 1.1 tm? -67.83 -44.48 77.12 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.145 -0.479 . . . . 60.420000000000002 110.951 179.99 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -71.7 -27.94 70.03 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.721 -0.752 . . . . 43.409999999999997 112.532 179.87 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 96.5 m -70.31 -53.64 15.95 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.867 0.365 . . . . 73.310000000000002 111.128 -179.869 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.695 HG11 ' CD1' ' A' ' 19' ' ' PHE . 46.8 t -52.53 -51.7 32.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.189 -0.459 . . . . 75.319999999999993 111.105 179.937 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . 0.569 ' HE3' HG13 ' M' ' 34' ' ' ILE . 0.0 OUTLIER -51.89 -39.41 58.99 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.174 -0.466 . . . . 74.219999999999999 110.895 179.919 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 21.7 ttt-85 -57.01 -44.67 83.05 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.241 -0.436 . . . . 73.439999999999998 110.824 -179.894 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . 0.621 ' OG ' HD11 ' M' ' 41' ' ' LEU . 1.1 p -67.49 -26.34 66.31 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.217 -0.447 . . . . 64.540000000000006 110.835 -179.74 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.966 HD13 ' HB3' ' M' ' 37' ' ' ALA . 48.7 mt -85.64 -21.39 28.44 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.084 -0.507 . . . . 70.219999999999999 110.927 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 101.44 31.14 5.64 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.736 -0.745 . . . . 73.319999999999993 112.498 179.941 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 10.6 mt-30 -119.56 122.69 42.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.777 0.322 . . . . 44.119999999999997 110.94 -179.896 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 22.7 t-20 -109.86 76.84 0.99 Allowed Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 121.627 0.727 . . . . 73.209999999999994 110.918 -179.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . 0.541 ' HG2' HD21 ' A' ' 48' ' ' LEU . 53.9 Cg_endo -69.76 140.23 42.19 Favored 'Trans proline' 0 C--N 1.342 0.196 0 C-N-CA 122.68 2.253 . . . . 73.120000000000005 112.359 179.938 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 29.6 p -72.64 161.63 30.53 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.209 -0.45 . . . . 62.509999999999998 111.154 -179.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 67.9 tt0 -52.04 -42.9 63.47 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.22 -0.446 . . . . 72.25 110.919 179.978 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.0 -31.54 64.56 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.184 -0.462 . . . . 72.329999999999998 111.131 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 55.5 tt0 -66.22 -50.48 63.69 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.157 -0.474 . . . . 74.420000000000002 110.872 -179.915 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.541 HD21 ' HG2' ' A' ' 43' ' ' PRO . 40.5 mt -55.17 -47.12 75.62 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.153 -0.476 . . . . 75.140000000000001 110.908 -179.954 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 21.1 tp60 -66.42 -29.03 69.09 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.203 -0.453 . . . . 73.510000000000005 110.847 179.96 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 37.9 t0 -70.68 -49.57 45.88 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.26 -0.427 . . . . 74.209999999999994 110.877 179.945 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 31.8 mtp -59.54 -57.98 10.6 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.174 -0.466 . . . . 75.400000000000006 110.874 179.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.637 HD12 HG22 ' A' ' 29' ' ' THR . 61.7 mt -53.29 -43.82 51.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.181 -0.463 . . . . 73.519999999999996 111.108 179.985 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 71.7 m-20 -64.0 -38.84 92.54 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.145 -0.48 . . . . 65.420000000000002 110.906 179.952 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -60.62 -32.08 71.24 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.185 -0.462 . . . . 72.450000000000003 110.889 179.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 26.5 m -105.31 14.7 7.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.141 -0.481 . . . . 74.109999999999999 111.118 -180.0 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 31.0 t0 -90.07 100.19 13.06 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.201 -0.454 . . . . 51.219999999999999 110.874 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.23 -45.85 9.73 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.206 -0.452 . . . . 64.230000000000004 111.084 179.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 16.8 p-10 -81.67 -0.19 41.55 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.246 -0.433 . . . . 73.420000000000002 110.87 179.952 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 53.42 56.15 21.15 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.743 -0.742 . . . . 63.420000000000002 112.473 -179.978 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 52.0 p-10 -114.49 -15.71 12.01 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.858 0.361 . . . . 73.299999999999997 110.907 -179.903 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 91.73 15.59 54.26 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.743 -0.741 . . . . 71.239999999999995 112.525 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . 0.54 HG21 HG22 ' A' ' 28' ' ' THR . 40.0 p -148.01 163.75 35.9 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.776 0.322 . . . . 74.25 111.139 -179.843 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 24.2 mt -99.9 109.5 24.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.2 -0.454 . . . . 75.230000000000004 111.141 179.868 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 4.6 t0 -75.42 -172.97 1.94 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.155 -0.475 . . . . 71.049999999999997 110.831 179.863 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.53 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 2.5 t80 -65.68 -58.42 11.62 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 121.618 0.723 . . . . 74.239999999999995 110.891 -179.886 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . 0.53 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 54.1 Cg_endo -69.74 -25.5 28.65 Favored 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.667 2.245 . . . . 52.009999999999998 112.376 179.961 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 17.4 mt-10 -61.61 -43.57 98.62 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.222 -0.444 . . . . 63.329999999999998 110.871 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 21.7 t80 -71.21 -36.21 71.8 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.172 -0.467 . . . . 72.219999999999999 110.921 -179.958 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.534 HD13 ' HB3' ' A' ' 12' ' ' PHE . 21.4 tp -62.56 -53.79 49.46 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.133 -0.485 . . . . 74.239999999999995 110.901 179.989 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 9.9 t -60.48 -30.96 70.02 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.146 -0.479 . . . . 60.530000000000001 111.116 179.951 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 7.9 tmm? -61.45 -46.76 88.74 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.233 -0.439 . . . . 74.409999999999997 110.902 179.914 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -76.07 -48.57 20.32 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.216 -0.447 . . . . 75.099999999999994 110.886 179.948 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.321 0 CA-C-N 116.267 -0.424 . . . . 53.509999999999998 111.107 179.923 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.422 HG21 HG22 ' A' ' 142' ' ' VAL . 67.3 mt . . . . . 0 C--O 1.232 0.139 0 CA-C-O 120.775 0.322 . . . . 75.530000000000001 111.115 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.06 -32.03 71.22 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.195 -0.457 . . . . 74.430000000000007 110.843 179.991 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.706 ' O ' HG23 ' A' ' 91' ' ' VAL . 8.3 tm-20 -75.67 -51.67 12.24 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.177 -0.465 . . . . 71.129999999999995 110.85 -179.881 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -54.73 -50.96 67.11 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.163 -0.472 . . . . 42.509999999999998 111.069 179.957 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 22.2 t80 -53.47 -44.49 69.01 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.207 -0.451 . . . . 75.530000000000001 110.839 -179.862 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 1.6 tmm_? -66.64 -46.04 77.05 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.176 -0.465 . . . . 72.239999999999995 110.889 -179.938 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . 0.706 HG23 ' O ' ' A' ' 87' ' ' GLU . 91.6 t -54.42 -51.02 53.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.18 -0.463 . . . . 75.519999999999996 111.11 -179.994 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.575 ' CE1' HG11 ' A' ' 108' ' ' VAL . 19.6 m-85 -66.13 -27.1 67.78 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.194 -0.457 . . . . 73.140000000000001 110.866 -179.978 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 31.4 t0 -69.67 95.21 0.85 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.13 -0.487 . . . . 60.439999999999998 110.855 179.989 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 5.7 mptp? -78.42 -52.59 8.33 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.198 -0.455 . . . . 73.340000000000003 110.865 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 44.2 p30 -72.63 -9.04 58.12 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.235 -0.438 . . . . 64.040000000000006 110.902 179.867 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 59.68 27.05 63.35 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.715 -0.755 . . . . 75.340000000000003 112.509 -179.951 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 40.0 p-10 -82.06 -16.19 50.98 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.847 0.356 . . . . 73.329999999999998 110.882 -179.928 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 84.79 18.67 61.1 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.683 -0.77 . . . . 55.229999999999997 112.517 179.978 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 20.6 m-85 -140.66 135.26 31.49 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.856 0.36 . . . . 73.420000000000002 110.936 -179.787 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 66.2 mt -102.27 126.83 56.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.125 -0.489 . . . . 75.5 111.164 179.908 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 28.7 p -111.66 -174.59 2.5 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.198 -0.456 . . . . 63.420000000000002 110.844 -179.891 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . 0.601 ' O ' HG11 ' A' ' 121' ' ' VAL . . . -71.2 -34.5 70.91 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.113 -0.494 . . . . 64.109999999999999 111.116 179.915 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -71.98 -44.83 62.88 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.209 -0.45 . . . . 75.319999999999993 111.089 179.935 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -69.09 -50.13 51.01 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.229 -0.441 . . . . 73.030000000000001 110.914 -179.934 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 42.5 tp -52.94 -33.3 50.22 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.183 -0.462 . . . . 74.540000000000006 110.94 179.991 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . 0.644 ' HB2' HG21 ' A' ' 121' ' ' VAL . 58.4 ttp85 -73.74 -36.95 65.22 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.202 -0.453 . . . . 61.240000000000002 110.896 179.943 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 2.0 t60 -54.34 -38.11 65.66 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.123 -0.49 . . . . 75.129999999999995 110.892 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.575 HG11 ' CE1' ' A' ' 92' ' ' PHE . 23.3 t -69.86 -48.14 65.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.162 -0.472 . . . . 64.230000000000004 111.137 179.961 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' MET . . . . . 0.464 ' HB3' HD12 ' A' ' 116' ' ' LEU . 2.4 mmt -59.72 -38.27 81.22 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.196 -0.456 . . . . 73.510000000000005 110.902 179.906 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 8.0 m -52.25 -43.03 64.13 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.218 -0.446 . . . . 65.329999999999998 111.176 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -68.34 -28.91 67.56 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.203 -0.453 . . . . 65.25 110.874 179.978 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.433 ' O ' HD23 ' A' ' 112' ' ' LEU . 1.1 tt -70.87 -26.12 63.11 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.207 -0.452 . . . . 63.539999999999999 110.893 179.96 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 99.81 30.57 6.38 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.712 -0.756 . . . . 52.240000000000002 112.476 179.921 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -115.87 113.39 23.28 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.892 0.377 . . . . 75.519999999999996 110.884 -179.856 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 14.9 pttp -64.19 116.24 5.79 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.187 -0.46 . . . . 73.549999999999997 110.91 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.464 HD12 ' HB3' ' A' ' 109' ' ' MET . 14.2 mt -145.25 133.36 21.5 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.231 -0.441 . . . . 75.310000000000002 110.893 179.964 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . 0.653 ' O ' HG23 ' A' ' 121' ' ' VAL . 27.8 p -107.42 -177.13 3.26 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.167 -0.469 . . . . 72.400000000000006 111.153 179.994 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -58.91 -37.78 77.43 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.264 -0.425 . . . . 75.030000000000001 110.826 179.907 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 61.5 tt0 -73.91 -33.92 64.18 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.181 -0.463 . . . . 63.530000000000001 110.86 -179.895 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . 0.41 ' HG2' HD22 ' A' ' 116' ' ' LEU . 10.4 tt0 -74.06 -37.21 64.32 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.172 -0.467 . . . . 73.0 110.874 -179.901 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.653 HG23 ' O ' ' A' ' 117' ' ' THR . 61.0 t -74.29 -31.0 27.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.137 -0.483 . . . . 74.040000000000006 111.106 179.991 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -52.01 -45.32 64.5 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.172 -0.467 . . . . 71.219999999999999 110.864 179.903 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 21.5 tp10 -56.07 -29.69 60.9 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.186 -0.461 . . . . 52.130000000000003 110.887 -179.893 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . 0.421 ' HE3' ' HB3' ' M' ' 15' ' ' LYS . 14.6 mtp -75.06 -57.39 3.93 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.161 -0.472 . . . . 70.450000000000003 110.823 179.985 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.444 HG13 ' HB2' ' A' ' 102' ' ' ALA . 35.8 mm -53.88 -35.65 28.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.233 -0.439 . . . . 71.409999999999997 111.151 -179.992 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 22.1 ttp85 -63.38 -31.8 73.05 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.125 -0.489 . . . . 70.319999999999993 110.861 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 20.0 tp10 -75.01 -52.41 11.15 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.21 -0.45 . . . . 70.549999999999997 110.861 -179.922 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.674 ' HB3' HG22 ' A' ' 136' ' ' VAL . . . -64.96 -34.41 78.37 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.175 -0.466 . . . . 63.109999999999999 111.106 179.952 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 49.2 t0 -68.42 86.67 0.29 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.208 -0.451 . . . . 61.130000000000003 110.888 179.96 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 58.0 mt -79.8 -46.34 22.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.218 -0.446 . . . . 63.240000000000002 111.139 179.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 21.2 p30 -72.66 -8.74 56.83 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.225 -0.443 . . . . 72.349999999999994 110.87 179.837 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 62.79 42.97 99.59 Favored Glycine 0 N--CA 1.452 -0.245 0 C-N-CA 120.738 -0.744 . . . . 40.530000000000001 112.456 -179.912 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 34.6 p-10 -88.07 -15.89 35.05 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.809 0.338 . . . . 71.439999999999998 110.879 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 104.11 2.25 45.11 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.709 -0.758 . . . . 74.299999999999997 112.514 -179.932 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 4.0 tt0 -149.14 172.24 15.13 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.852 0.358 . . . . 72.019999999999996 110.903 -179.876 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 136' ' ' VAL . . . . . 0.674 HG22 ' HB3' ' A' ' 128' ' ' ALA . 92.9 t -106.75 109.87 29.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.213 -0.449 . . . . 55.409999999999997 111.093 179.951 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 20.4 p30 -90.97 164.86 13.84 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.15 -0.477 . . . . 72.409999999999997 110.903 179.921 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 138' ' ' TYR . . . . . 0.603 ' O ' HG23 ' A' ' 142' ' ' VAL . 70.1 t80 -52.05 -46.72 65.19 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.135 -0.484 . . . . 72.519999999999996 110.922 -179.932 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 11.5 tm-20 -51.92 -39.98 60.02 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.148 -0.478 . . . . 70.209999999999994 110.873 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 22.5 mt-10 -78.41 -41.69 32.36 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.153 -0.476 . . . . 75.409999999999997 110.929 -179.923 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 64.6 t80 -59.29 -35.8 74.41 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.128 -0.487 . . . . 75.530000000000001 110.899 -179.957 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . 0.603 HG23 ' O ' ' A' ' 138' ' ' TYR . 91.4 t -71.28 -37.87 67.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.153 -0.476 . . . . 74.340000000000003 111.137 179.953 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 39.9 tp60 -73.94 -31.23 62.95 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.199 -0.455 . . . . 73.439999999999998 110.922 179.986 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 9.0 tpt -74.11 -56.54 4.79 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.2 -0.454 . . . . 73.140000000000001 110.877 179.948 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 12.3 ttm -61.48 -26.09 67.67 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.286 -0.415 . . . . 63.439999999999998 110.879 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 2.5 m . . . . . 0 C--N 1.329 -0.314 0 CA-C-N 116.229 -0.442 . . . . 70.439999999999998 111.107 -179.87 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' M' M ' 15' ' ' LYS . . . . . 0.421 ' HB3' ' HE3' ' A' ' 124' ' ' MET . 18.9 mttp . . . . . 0 C--O 1.232 0.135 0 CA-C-O 120.751 0.31 . . . . 54.520000000000003 110.871 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' M' M ' 16' ' ' TRP . . . . . 0.723 ' CE3' HD12 ' M' ' 19' ' ' ILE . 10.6 m95 -51.76 -46.91 64.26 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.247 -0.433 . . . . 75.510000000000005 110.944 179.904 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' M' M ' 17' ' ' GLU . . . . . . . . . . . . . 3.1 tm-20 -55.36 -27.1 45.09 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.189 -0.46 . . . . 75.340000000000003 110.889 -179.965 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' M' M ' 18' ' ' LYS . . . . . . . . . . . . . 8.7 ttmm -75.61 -28.93 59.05 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.127 -0.488 . . . . 74.209999999999994 110.891 179.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' M' M ' 19' ' ' ILE . . . . . 0.723 HD12 ' CE3' ' M' ' 16' ' ' TRP . 54.5 mt -78.95 -24.86 13.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.207 -0.451 . . . . 71.5 111.166 179.832 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' M' M ' 20' ' ' ARG . . . . . . . . . . . . . 48.7 ttp180 . . . . . 0 C--N 1.329 -0.287 0 CA-C-N 116.154 -0.475 . . . . 70.200000000000003 110.851 179.996 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' M' M ' 30' ' ' LYS . . . . . . . . . . . . . 2.1 ptmt . . . . . 0 C--O 1.232 0.167 0 CA-C-O 120.759 0.314 . . . . 54.420000000000002 110.864 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' M' M ' 31' ' ' LEU . . . . . 0.536 ' O ' HD12 ' M' ' 31' ' ' LEU . 10.0 tp -118.87 -31.38 4.8 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.233 -0.439 . . . . 63.310000000000002 110.945 179.937 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' M' M ' 32' ' ' LYS . . . . . 0.401 ' O ' HG23 ' M' ' 35' ' ' VAL . 5.4 mtpm? -49.89 -44.61 50.08 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.155 -0.475 . . . . 73.430000000000007 110.89 179.821 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' M' M ' 33' ' ' HIS . . . . . . . . . . . . . 3.6 t60 -50.71 -37.31 40.72 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.272 -0.422 . . . . 71.299999999999997 110.839 179.909 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' M' M ' 34' ' ' ILE . . . . . 0.569 HG13 ' HE3' ' A' ' 36' ' ' MET . 49.3 mm -50.27 -39.65 16.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.197 -0.456 . . . . 65.519999999999996 111.12 179.977 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' M' M ' 35' ' ' VAL . . . . . 0.401 HG23 ' O ' ' M' ' 32' ' ' LYS . 40.1 t -49.31 -39.95 13.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.159 -0.473 . . . . 73.409999999999997 111.123 179.876 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' M' M ' 36' ' ' TRP . . . . . . . . . . . . . 24.8 m0 -58.78 -39.45 81.07 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.173 -0.467 . . . . 75.230000000000004 110.96 179.964 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' M' M ' 37' ' ' ALA . . . . . 0.966 ' HB3' HD13 ' A' ' 39' ' ' LEU . . . -64.1 -18.62 64.57 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.257 -0.429 . . . . 74.299999999999997 111.084 179.851 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' M' M ' 38' ' ' SER . . . . . 0.42 ' CB ' HD23 ' A' ' 18' ' ' LEU . 0.7 OUTLIER -73.29 -17.92 61.26 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.227 -0.442 . . . . 74.150000000000006 110.877 -179.782 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' M' M ' 39' ' ' ARG . . . . . . . . . . . . . 22.5 mmm180 -62.76 -25.18 68.08 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.149 -0.478 . . . . 71.099999999999994 110.837 -179.94 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' M' M ' 40' ' ' GLU . . . . . . . . . . . . . 7.0 mp0 -77.21 -48.03 18.66 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.211 -0.45 . . . . 73.400000000000006 110.898 -179.917 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' M' M ' 41' ' ' LEU . . . . . 0.621 HD11 ' OG ' ' A' ' 38' ' ' SER . 18.0 mt . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 116.103 -0.499 . . . . 60.399999999999999 110.904 -179.932 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 19.3 tt0 . . . . . 0 C--O 1.232 0.137 0 CA-C-O 120.794 0.33 . . . . 74.209999999999994 110.864 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 64.2 mt -69.84 -37.23 72.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.186 -0.461 . . . . 74.25 111.139 179.951 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -52.16 -50.81 61.06 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.203 -0.453 . . . . 43.520000000000003 111.097 179.831 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 17.5 mt-10 -57.02 -52.22 66.14 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.187 -0.46 . . . . 65.030000000000001 110.847 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.526 ' CB ' HD13 ' A' ' 69' ' ' LEU . 45.7 m-85 -58.02 -42.36 85.09 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.206 -0.452 . . . . 75.129999999999995 110.879 -179.907 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 21.7 ttpp -51.88 -41.26 61.77 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.114 -0.494 . . . . 74.140000000000001 110.932 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 56.5 tt0 -62.81 -32.87 74.15 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.261 -0.427 . . . . 74.510000000000005 110.829 180.0 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -68.91 -37.63 79.07 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.15 -0.477 . . . . 74.310000000000002 111.062 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 89.8 t80 -69.96 -53.22 18.77 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.257 -0.429 . . . . 75.310000000000002 110.912 -179.911 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 1.7 t -52.04 -35.79 48.3 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.153 -0.476 . . . . 71.230000000000004 110.855 -179.824 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 18.7 tp -59.81 -45.71 91.48 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.129 -0.487 . . . . 73.540000000000006 110.931 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.648 ' CD1' HG11 ' A' ' 35' ' ' VAL . 20.8 m-85 -73.07 -34.08 66.02 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.193 -0.458 . . . . 74.019999999999996 110.88 179.911 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 9.6 t0 -76.37 98.43 4.53 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.175 -0.466 . . . . 72.420000000000002 110.897 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 3.0 ttmp? -71.38 -55.73 7.39 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.188 -0.46 . . . . 72.230000000000004 110.903 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 22.3 p-10 -74.82 -10.04 59.12 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.227 -0.442 . . . . 74.409999999999997 110.863 179.867 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 52.25 44.26 57.67 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.732 -0.747 . . . . 72.040000000000006 112.486 -179.934 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 35.7 p-10 -89.58 -15.8 32.05 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.88 0.371 . . . . 70.409999999999997 110.893 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 103.92 -11.63 52.67 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.716 -0.754 . . . . 71.409999999999997 112.501 -179.906 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 19.8 p -128.01 133.26 49.13 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.736 0.303 . . . . 70.329999999999998 111.144 -179.866 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 24.5 mt -103.94 111.54 33.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.22 -0.445 . . . . 64.439999999999998 111.119 179.934 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.697 HG22 HG21 ' A' ' 62' ' ' THR . 20.3 p -94.81 -179.73 4.95 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.158 -0.474 . . . . 61.200000000000003 111.138 179.991 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 65.3 p -61.05 -32.04 71.67 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.185 -0.461 . . . . 75.349999999999994 111.164 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 24.1 tptm -68.31 -50.11 55.76 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.18 -0.463 . . . . 70.400000000000006 110.921 179.867 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.481 ' O ' HG23 ' A' ' 35' ' ' VAL . 35.9 mt-10 -70.33 -32.7 70.55 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.208 -0.451 . . . . 44.310000000000002 110.907 179.937 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.845 HD12 HD22 ' A' ' 48' ' ' LEU . 0.9 OUTLIER -74.14 -41.2 61.93 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.145 -0.48 . . . . 71.439999999999998 110.917 -179.963 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -71.72 -41.01 57.57 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.738 -0.744 . . . . 73.510000000000005 112.478 179.902 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 97.3 m -56.69 -56.43 21.47 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.82 0.343 . . . . 73.549999999999997 111.079 -179.839 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.648 HG11 ' CD1' ' A' ' 19' ' ' PHE . 91.9 t -52.01 -44.78 39.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.227 -0.442 . . . . 74.349999999999994 111.117 179.953 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 6.1 mmm -56.38 -34.46 66.7 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.173 -0.467 . . . . 54.020000000000003 110.913 179.874 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 35.9 ttp85 -57.53 -55.26 37.12 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.195 -0.457 . . . . 72.109999999999999 110.899 -179.912 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . 0.589 ' OG ' HD21 ' M' ' 41' ' ' LEU . 3.4 t -59.09 -27.0 65.15 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.205 -0.452 . . . . 71.030000000000001 110.842 -179.825 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.957 HD13 ' HB3' ' M' ' 37' ' ' ALA . 55.7 mt -78.98 -16.46 56.9 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.176 -0.466 . . . . 64.140000000000001 110.957 179.986 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 101.55 26.38 7.69 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.751 -0.738 . . . . 41.210000000000001 112.461 179.881 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 17.3 mt-30 -133.38 123.06 24.7 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.801 0.334 . . . . 70.230000000000004 110.92 -179.878 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 2.0 t30 -109.82 76.9 0.99 Allowed Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.6 0.714 . . . . 71.150000000000006 110.9 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . 0.656 ' CG ' HD21 ' A' ' 48' ' ' LEU . 53.8 Cg_endo -69.79 161.81 44.51 Favored 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.651 2.234 . . . . 75.329999999999998 112.344 179.94 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 34.1 p -100.14 168.74 9.62 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.195 -0.457 . . . . 74.430000000000007 111.12 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 4.4 mp0 -54.43 -51.1 66.0 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.171 -0.468 . . . . 74.400000000000006 110.861 -179.972 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -67.28 -31.5 71.87 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.174 -0.467 . . . . 71.430000000000007 111.143 179.931 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -65.35 -46.77 78.87 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.199 -0.455 . . . . 73.129999999999995 110.866 -179.941 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.845 HD22 HD12 ' A' ' 32' ' ' LEU . 18.3 mt -67.78 -51.9 43.48 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.188 -0.46 . . . . 71.420000000000002 110.922 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 12.5 tp60 -52.91 -28.49 23.59 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.217 -0.447 . . . . 63.130000000000003 110.962 179.901 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -64.42 -49.83 70.0 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.159 -0.473 . . . . 63.299999999999997 110.888 179.973 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 6.1 ptp -76.35 -35.71 58.57 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.175 -0.466 . . . . 62.229999999999997 110.882 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 81.8 mt -66.09 -38.35 81.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.205 -0.452 . . . . 70.140000000000001 111.138 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 28.0 m-20 -63.59 -43.23 97.55 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.125 -0.489 . . . . 74.349999999999994 110.836 179.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -57.9 -43.54 86.23 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.204 -0.453 . . . . 73.140000000000001 110.856 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 36.0 m -81.56 -13.14 12.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.197 -0.456 . . . . 74.430000000000007 111.124 179.977 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 38.2 t0 -66.89 97.61 0.49 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.198 -0.456 . . . . 73.439999999999998 110.82 179.973 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.19 -44.31 10.98 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.156 -0.475 . . . . 65.329999999999998 111.132 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 9.3 p-10 -81.74 -0.17 41.76 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.207 -0.451 . . . . 74.219999999999999 110.837 179.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 54.51 57.37 17.7 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.716 -0.754 . . . . 70.400000000000006 112.507 -179.942 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 52.1 p-10 -114.53 -15.81 11.97 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.859 0.361 . . . . 63.43 110.852 -179.848 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 93.82 15.89 47.39 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.744 -0.741 . . . . 63.149999999999999 112.453 179.963 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . 0.697 HG21 HG22 ' A' ' 28' ' ' THR . 44.6 p -148.84 175.34 11.34 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.763 0.316 . . . . 73.120000000000005 111.13 -179.857 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 19.2 mt -107.84 109.78 29.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.197 -0.456 . . . . 74.010000000000005 111.161 179.897 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.4 t0 -75.28 -172.93 1.88 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.181 -0.463 . . . . 75.409999999999997 110.818 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.531 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 2.5 t80 -65.29 -58.28 12.68 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-O 121.635 0.731 . . . . 75.140000000000001 110.888 -179.933 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . 0.531 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 53.6 Cg_endo -69.76 -26.42 27.6 Favored 'Trans proline' 0 C--N 1.341 0.146 0 C-N-CA 122.649 2.233 . . . . 74.430000000000007 112.364 -179.994 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 20.3 mt-10 -62.07 -40.57 96.26 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.199 -0.455 . . . . 75.109999999999999 110.891 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 17.2 t80 -74.36 -35.86 63.57 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.158 -0.474 . . . . 75.099999999999994 110.903 -179.925 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.526 HD13 ' CB ' ' A' ' 12' ' ' PHE . 33.6 tp -69.92 -53.9 15.79 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.098 -0.501 . . . . 64.340000000000003 110.916 -179.958 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 14.0 t -53.29 -30.69 40.1 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.175 -0.466 . . . . 73.25 111.155 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 36.2 ttp -58.79 -50.62 73.27 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.222 -0.444 . . . . 71.099999999999994 110.856 179.956 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 1.4 mmt -66.08 -48.81 69.74 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.263 -0.426 . . . . 72.230000000000004 110.891 179.932 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.309 0 CA-C-N 116.262 -0.426 . . . . 72.409999999999997 111.055 179.904 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.834 HG21 HG22 ' A' ' 142' ' ' VAL . 56.3 mt . . . . . 0 C--O 1.231 0.101 0 CA-C-O 120.805 0.336 . . . . 75.420000000000002 111.08 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 44.8 ttp180 -53.99 -33.49 57.2 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.188 -0.46 . . . . 72.25 110.843 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.716 ' O ' HG23 ' A' ' 91' ' ' VAL . 28.2 tt0 -76.63 -57.45 3.85 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.215 -0.448 . . . . 73.310000000000002 110.858 -179.879 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -53.53 -48.54 68.96 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.15 -0.477 . . . . 61.140000000000001 111.113 179.938 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 7.0 t80 -52.02 -51.26 58.57 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.21 -0.45 . . . . 71.120000000000005 110.855 -179.942 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 2.1 tmt_? -62.52 -46.95 86.05 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.166 -0.47 . . . . 72.299999999999997 110.891 -179.892 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . 0.716 HG23 ' O ' ' A' ' 87' ' ' GLU . 87.8 t -51.88 -47.91 40.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.189 -0.46 . . . . 71.450000000000003 111.143 179.941 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 18.6 m-85 -73.57 -26.48 60.85 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.148 -0.478 . . . . 64.409999999999997 110.889 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 31.6 t0 -69.77 95.2 0.87 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.118 -0.492 . . . . 73.5 110.854 179.985 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -78.65 -52.51 8.33 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.188 -0.46 . . . . 72.239999999999995 110.89 -179.998 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 53.6 p30 -72.66 -9.16 58.28 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.213 -0.448 . . . . 53.43 110.862 179.91 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 59.87 28.0 65.24 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.711 -0.757 . . . . 53.25 112.492 -179.955 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 46.0 p-10 -82.08 -16.14 51.06 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.871 0.367 . . . . 64.040000000000006 110.894 -179.859 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 88.1 18.66 55.39 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.743 -0.742 . . . . 25.539999999999999 112.507 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 12.9 m-85 -138.89 151.98 47.39 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.862 0.363 . . . . 74.409999999999997 110.911 -179.782 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 70.8 mt -115.73 122.34 69.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.154 -0.476 . . . . 65.439999999999998 111.167 179.907 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 53.4 p -114.81 -172.58 2.15 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.191 -0.459 . . . . 72.230000000000004 110.871 -179.877 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -74.75 -39.77 61.64 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.179 -0.464 . . . . 74.219999999999999 111.154 179.872 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -62.72 -39.98 95.77 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.188 -0.46 . . . . 55.200000000000003 111.09 179.906 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 21.6 mt-10 -76.95 -46.75 23.05 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.217 -0.447 . . . . 75.319999999999993 110.863 -179.89 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 29.7 tp -53.16 -43.97 67.46 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.136 -0.484 . . . . 74.400000000000006 110.926 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . 0.45 ' O ' HG23 ' A' ' 110' ' ' THR . 21.7 ttt-85 -51.99 -39.13 58.92 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.175 -0.466 . . . . 70.310000000000002 110.868 179.933 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 16.3 t60 -63.3 -35.53 80.67 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.192 -0.458 . . . . 70.120000000000005 110.847 -179.965 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 90.7 t -70.04 -52.29 32.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.218 -0.446 . . . . 50.329999999999998 111.143 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' MET . . . . . 0.461 ' HB3' HD12 ' A' ' 116' ' ' LEU . 1.6 mmt -61.46 -44.68 96.67 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.172 -0.467 . . . . 74.109999999999999 110.849 179.906 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . 0.45 HG23 ' O ' ' A' ' 106' ' ' ARG . 12.9 p -53.01 -32.78 48.5 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.249 -0.432 . . . . 72.439999999999998 111.17 -179.871 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 8.9 t30 -74.62 -31.01 61.86 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.209 -0.451 . . . . 72.040000000000006 110.868 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.424 ' O ' HD23 ' A' ' 112' ' ' LEU . 1.1 tt -70.7 -26.07 63.25 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.193 -0.458 . . . . 72.5 110.925 179.966 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 100.12 23.28 10.69 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.758 -0.734 . . . . 61.210000000000001 112.468 179.928 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 54.7 tp10 -104.3 115.58 30.63 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.894 0.378 . . . . 75.329999999999998 110.88 -179.861 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . 0.464 ' O ' HD23 ' A' ' 116' ' ' LEU . 14.0 pttp -64.82 117.77 8.01 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.156 -0.475 . . . . 75.030000000000001 110.884 179.968 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.464 HD23 ' O ' ' A' ' 115' ' ' LYS . 17.2 mt -146.75 130.66 17.16 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.196 -0.456 . . . . 73.430000000000007 110.912 179.901 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . 0.475 ' O ' HG23 ' A' ' 121' ' ' VAL . 32.6 p -92.13 170.9 9.46 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.162 -0.472 . . . . 71.120000000000005 111.193 179.964 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 60.3 m-20 -53.24 -43.37 67.28 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.262 -0.426 . . . . 74.0 110.909 179.867 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 16.5 tp10 -65.55 -35.02 79.62 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.187 -0.461 . . . . 73.310000000000002 110.837 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . 0.422 ' HG2' HD22 ' A' ' 116' ' ' LEU . 2.2 tp10 -65.97 -40.72 91.5 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.178 -0.464 . . . . 71.439999999999998 110.859 -179.875 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.475 HG23 ' O ' ' A' ' 117' ' ' THR . 30.6 t -61.29 -38.94 80.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.147 -0.479 . . . . 74.019999999999996 111.164 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -52.02 -48.92 64.27 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.138 -0.483 . . . . 73.400000000000006 110.836 179.946 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -56.22 -29.3 60.78 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.203 -0.453 . . . . 74.140000000000001 110.859 -179.905 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . 0.465 ' HE1' HD11 ' M' ' 19' ' ' ILE . 0.1 OUTLIER -73.37 -59.62 2.62 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.191 -0.459 . . . . 64.439999999999998 110.831 179.997 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.44 HG23 HG23 ' A' ' 136' ' ' VAL . 33.0 mm -54.06 -35.81 29.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.238 -0.437 . . . . 55.240000000000002 111.134 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 69.2 ttt180 -63.44 -31.77 73.03 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.163 -0.471 . . . . 73.230000000000004 110.921 179.906 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 6.7 tp10 -71.43 -44.34 65.04 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.21 -0.45 . . . . 73.200000000000003 110.934 -179.959 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.714 ' HB3' HG22 ' A' ' 136' ' ' VAL . . . -76.06 -26.58 56.68 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.113 -0.494 . . . . 70.519999999999996 111.085 179.94 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 43.1 t0 -68.04 87.52 0.26 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.189 -0.46 . . . . 74.420000000000002 110.88 179.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 130' ' ' ILE . . . . . 0.42 HD12 ' HG2' ' A' ' 140' ' ' GLU . 60.8 mt -79.91 -49.33 19.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.175 -0.466 . . . . 70.510000000000005 111.126 -179.978 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 18.8 p30 -72.91 -8.7 56.82 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.167 -0.47 . . . . 72.200000000000003 110.841 179.842 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 63.9 44.67 95.73 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.751 -0.738 . . . . 71.120000000000005 112.521 -179.907 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 35.8 p-10 -91.18 -15.88 28.6 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.884 0.373 . . . . 65.120000000000005 110.862 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 104.19 2.33 44.86 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.758 -0.734 . . . . 72.120000000000005 112.457 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 7.2 tt0 -149.19 172.2 15.22 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.775 0.321 . . . . 60.409999999999997 110.935 -179.9 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 136' ' ' VAL . . . . . 0.714 HG22 ' HB3' ' A' ' 128' ' ' ALA . 61.6 t -105.63 109.74 28.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.176 -0.466 . . . . 41.420000000000002 111.142 179.938 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 23.1 p30 -89.09 165.46 14.49 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.167 -0.47 . . . . 71.329999999999998 110.934 179.948 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 138' ' ' TYR . . . . . 0.62 ' O ' HG23 ' A' ' 142' ' ' VAL . 87.1 t80 -52.05 -47.2 65.21 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.158 -0.474 . . . . 72.310000000000002 110.921 -179.898 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -52.01 -37.98 55.21 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.144 -0.48 . . . . 64.340000000000003 110.881 179.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 140' ' ' GLU . . . . . 0.42 ' HG2' HD12 ' A' ' 130' ' ' ILE . 19.4 mt-10 -78.39 -47.72 17.03 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.149 -0.478 . . . . 73.310000000000002 110.875 -179.906 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 65.2 t80 -54.33 -36.24 63.55 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.152 -0.476 . . . . 73.319999999999993 110.912 -179.936 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . 0.834 HG22 HG21 ' A' ' 85' ' ' ILE . 90.0 t -70.81 -43.04 77.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.147 -0.479 . . . . 42.130000000000003 111.16 179.93 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 20.5 tt0 -68.35 -29.98 68.83 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.162 -0.472 . . . . 73.439999999999998 110.872 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 7.9 tpt -72.03 -56.6 5.35 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.254 -0.43 . . . . 61.329999999999998 110.897 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 9.7 ttm -65.91 -26.06 67.44 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.256 -0.429 . . . . 65.239999999999995 110.891 179.927 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 2.1 m . . . . . 0 C--N 1.329 -0.294 0 CA-C-N 116.238 -0.437 . . . . 73.329999999999998 111.135 -179.92 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' M' M ' 15' ' ' LYS . . . . . 0.42 ' HB3' ' HE3' ' A' ' 124' ' ' MET . 20.4 mtmm . . . . . 0 C--O 1.231 0.12 0 CA-C-O 120.731 0.301 . . . . 63.140000000000001 110.877 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' M' M ' 16' ' ' TRP . . . . . 0.401 ' CE3' HD12 ' M' ' 19' ' ' ILE . 26.4 m95 -52.28 -43.13 64.27 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.242 -0.435 . . . . 71.219999999999999 110.899 179.948 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' M' M ' 17' ' ' GLU . . . . . . . . . . . . . 24.5 tt0 -54.48 -27.52 38.39 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.223 -0.444 . . . . 72.129999999999995 110.903 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' M' M ' 18' ' ' LYS . . . . . . . . . . . . . 15.8 ttpt -69.7 -30.6 68.27 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.157 -0.474 . . . . 62.149999999999999 110.899 179.961 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' M' M ' 19' ' ' ILE . . . . . 0.465 HD11 ' HE1' ' A' ' 124' ' ' MET . 43.9 mt -80.91 -25.02 10.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.22 -0.445 . . . . 64.510000000000005 111.13 179.867 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' M' M ' 20' ' ' ARG . . . . . . . . . . . . . 31.9 ttm180 . . . . . 0 C--N 1.329 -0.297 0 CA-C-N 116.206 -0.452 . . . . 71.420000000000002 110.881 179.973 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' M' M ' 30' ' ' LYS . . . . . . . . . . . . . 12.0 tttp . . . . . 0 C--O 1.232 0.154 0 CA-C-O 120.825 0.345 . . . . 74.5 110.867 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' M' M ' 31' ' ' LEU . . . . . 0.829 HD12 HD12 ' M' ' 34' ' ' ILE . 14.2 tp -70.62 -44.63 66.83 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.254 -0.43 . . . . 55.130000000000003 110.921 179.926 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' M' M ' 32' ' ' LYS . . . . . . . . . . . . . 5.7 mtmt -48.63 -44.87 37.73 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.182 -0.463 . . . . 75.450000000000003 110.894 179.851 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' M' M ' 33' ' ' HIS . . . . . . . . . . . . . 73.9 t60 -50.39 -39.33 46.65 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.227 -0.442 . . . . 74.099999999999994 110.843 179.898 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' M' M ' 34' ' ' ILE . . . . . 0.829 HD12 HD12 ' M' ' 31' ' ' LEU . 66.0 mt -50.6 -39.37 17.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.204 -0.453 . . . . 75.129999999999995 111.157 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' M' M ' 35' ' ' VAL . . . . . . . . . . . . . 39.8 t -49.36 -39.8 13.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.179 -0.464 . . . . 63.439999999999998 111.121 179.861 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' M' M ' 36' ' ' TRP . . . . . . . . . . . . . 24.2 m0 -58.71 -39.69 81.53 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.182 -0.463 . . . . 75.420000000000002 110.918 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' M' M ' 37' ' ' ALA . . . . . 0.957 ' HB3' HD13 ' A' ' 39' ' ' LEU . . . -63.87 -18.72 64.45 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.256 -0.429 . . . . 71.310000000000002 111.113 179.829 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' M' M ' 38' ' ' SER . . . . . . . . . . . . . 1.2 m -70.71 -17.91 62.81 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.266 -0.425 . . . . 73.530000000000001 110.873 -179.801 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' M' M ' 39' ' ' ARG . . . . . . . . . . . . . 37.2 mtp180 -53.29 -28.62 28.95 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.129 -0.487 . . . . 75.120000000000005 110.88 -179.916 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' M' M ' 40' ' ' GLU . . . . . . . . . . . . . 16.0 tp10 -85.98 -47.97 9.11 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.151 -0.477 . . . . 74.329999999999998 110.864 -179.912 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' M' M ' 41' ' ' LEU . . . . . 0.589 HD21 ' OG ' ' A' ' 38' ' ' SER . 10.5 mt . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 116.152 -0.476 . . . . 75.230000000000004 110.947 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.232 0.152 0 CA-C-O 120.775 0.321 . . . . 75.099999999999994 110.86 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 3.3 mp -72.19 -40.06 65.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.21 -0.45 . . . . 63.520000000000003 111.138 179.977 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -53.59 -32.09 49.6 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.215 -0.448 . . . . 55.009999999999998 111.057 179.831 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 27.3 mm-40 -74.79 -52.18 12.15 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.271 -0.422 . . . . 51.240000000000002 110.888 -179.894 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 38.1 m-85 -59.55 -45.97 90.24 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.134 -0.485 . . . . 74.420000000000002 110.889 -179.938 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 33.0 ttpt -53.87 -35.8 61.96 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.134 -0.485 . . . . 74.150000000000006 110.872 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -65.11 -30.85 71.82 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.269 -0.423 . . . . 73.420000000000002 110.913 179.978 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -70.68 -48.29 55.5 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.158 -0.474 . . . . 74.519999999999996 111.069 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 89.5 t80 -55.65 -54.24 46.59 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.221 -0.445 . . . . 73.030000000000001 110.887 -179.91 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 27.7 t -53.92 -29.56 42.67 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.109 -0.496 . . . . 74.219999999999999 110.874 -179.792 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 15.6 tp -65.72 -44.32 86.41 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.094 -0.503 . . . . 62.240000000000002 110.914 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.644 ' CD1' HG11 ' A' ' 35' ' ' VAL . 56.0 m-85 -75.71 -25.89 57.04 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.153 -0.476 . . . . 75.530000000000001 110.888 179.935 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 12.8 t0 -79.53 98.53 6.88 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.16 -0.473 . . . . 53.450000000000003 110.889 179.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 10.4 ttpp -67.11 -50.75 60.4 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.216 -0.447 . . . . 75.200000000000003 110.903 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 24.0 p-10 -81.0 -10.16 59.75 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.206 -0.452 . . . . 74.420000000000002 110.919 179.847 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 51.73 42.48 52.61 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.728 -0.749 . . . . 53.100000000000001 112.457 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 22.9 p-10 -88.51 -15.79 34.36 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.85 0.357 . . . . 55.520000000000003 110.854 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 102.18 17.64 19.65 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.715 -0.755 . . . . 41.020000000000003 112.477 -179.938 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -154.64 130.79 10.31 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.777 0.322 . . . . 73.430000000000007 111.127 -179.866 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 23.5 mt -97.73 122.38 49.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.167 -0.469 . . . . 72.219999999999999 111.12 179.915 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.583 HG22 HG21 ' A' ' 62' ' ' THR . 21.4 p -105.48 176.72 5.07 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.166 -0.47 . . . . 34.340000000000003 111.142 179.958 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 72.3 p -61.18 -29.34 69.74 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.239 -0.437 . . . . 71.140000000000001 111.129 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 28.4 mmtp -72.7 -49.97 27.9 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.202 -0.454 . . . . 73.040000000000006 110.883 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.42 ' O ' HG23 ' A' ' 35' ' ' VAL . 34.9 mt-10 -68.93 -32.68 72.48 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.21 -0.45 . . . . 75.030000000000001 110.896 179.988 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.546 ' O ' HD13 ' A' ' 32' ' ' LEU . 1.0 OUTLIER -71.52 -43.35 66.62 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.134 -0.484 . . . . 40.140000000000001 110.882 -179.978 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -70.26 -28.14 71.84 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.73 -0.747 . . . . 52.25 112.492 179.903 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 92.9 m -71.91 -58.21 3.65 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.826 0.346 . . . . 64.150000000000006 111.114 -179.851 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.644 HG11 ' CD1' ' A' ' 19' ' ' PHE . 96.0 t -51.62 -49.46 34.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.252 -0.431 . . . . 73.430000000000007 111.09 179.933 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 6.4 ttt -60.33 -39.31 86.6 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.199 -0.455 . . . . 72.030000000000001 110.868 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 51.4 ttp85 -52.74 -43.2 65.58 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.243 -0.435 . . . . 73.040000000000006 110.891 -179.944 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . 0.562 ' OG ' HD21 ' M' ' 41' ' ' LEU . 1.7 t -70.28 -25.23 63.24 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.222 -0.445 . . . . 73.329999999999998 110.861 -179.8 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 1.004 HD13 ' HB3' ' M' ' 37' ' ' ALA . 57.1 mt -76.15 -20.92 57.14 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.108 -0.496 . . . . 74.109999999999999 110.932 179.981 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 101.48 30.01 6.07 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.771 -0.728 . . . . 71.150000000000006 112.511 179.916 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 15.4 mm-40 -128.9 122.56 30.54 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.829 0.347 . . . . 73.409999999999997 110.882 -179.897 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 33.7 t-20 -109.93 80.68 1.82 Allowed Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.589 0.709 . . . . 51.439999999999998 110.89 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.74 168.03 22.71 Favored 'Trans proline' 0 C--O 1.231 0.158 0 C-N-CA 122.671 2.247 . . . . 65.530000000000001 112.346 179.937 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 18.0 p -93.05 158.74 15.63 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.187 -0.46 . . . . 73.430000000000007 111.105 -179.938 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.3 pt-20 -51.66 -45.0 63.23 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.197 -0.456 . . . . 74.099999999999994 110.893 179.993 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -72.29 -31.32 65.62 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.16 -0.473 . . . . 42.420000000000002 111.088 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -69.98 -42.23 73.38 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.208 -0.451 . . . . 74.209999999999994 110.838 -179.853 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.51 HD23 HD12 ' A' ' 32' ' ' LEU . 15.1 mt -59.57 -50.98 71.79 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.187 -0.46 . . . . 71.219999999999999 110.932 179.969 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -71.91 -28.36 63.43 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.186 -0.461 . . . . 61.420000000000002 110.94 179.923 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 7.8 t0 -56.49 -49.8 73.64 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.18 -0.464 . . . . 74.400000000000006 110.813 179.978 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . 0.461 ' HE1' HD11 ' M' ' 34' ' ' ILE . 6.7 ptp -69.49 -37.67 77.34 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.216 -0.447 . . . . 71.340000000000003 110.895 -179.957 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 96.5 mt -62.08 -52.48 59.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.191 -0.458 . . . . 73.409999999999997 111.126 179.928 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -55.06 -32.95 62.31 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.17 -0.468 . . . . 64.319999999999993 110.857 179.952 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -60.4 -55.29 35.36 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.185 -0.461 . . . . 74.129999999999995 110.852 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 17.2 m -77.12 -13.1 14.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.215 -0.448 . . . . 74.140000000000001 111.108 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 41.9 t0 -66.74 96.39 0.4 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.192 -0.458 . . . . 70.129999999999995 110.879 179.916 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.25 -36.81 16.52 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.217 -0.447 . . . . 71.319999999999993 111.08 179.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -86.45 -0.23 55.57 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.177 -0.465 . . . . 74.540000000000006 110.894 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 51.93 60.99 6.89 Favored Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.747 -0.739 . . . . 75.5 112.52 -179.946 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 51.5 p-10 -114.61 -15.89 11.92 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.814 0.34 . . . . 73.120000000000005 110.841 -179.822 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 93.82 17.93 39.48 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.709 -0.758 . . . . 74.120000000000005 112.446 179.941 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . 0.583 HG21 HG22 ' A' ' 28' ' ' THR . 70.0 p -151.07 174.29 13.35 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.758 0.313 . . . . 74.040000000000006 111.146 -179.819 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.488 HD13 HD21 ' M' ' 31' ' ' LEU . 22.6 mt -104.84 110.93 32.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.279 -0.419 . . . . 75.329999999999998 111.163 179.897 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -75.12 -172.98 1.84 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.219 -0.446 . . . . 70.319999999999993 110.873 179.874 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.536 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 2.5 t80 -65.52 -58.31 12.18 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-O 121.644 0.735 . . . . 74.409999999999997 110.947 -179.916 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . 0.536 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 53.7 Cg_endo -69.77 -26.98 27.0 Favored 'Trans proline' 0 C--N 1.341 0.16 0 C-N-CA 122.636 2.224 . . . . 74.329999999999998 112.38 179.962 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -60.91 -41.41 96.04 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.186 -0.461 . . . . 75.349999999999994 110.879 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 8.3 t80 -74.58 -35.72 63.03 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.154 -0.476 . . . . 73.439999999999998 110.909 -179.923 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 18.6 tp -68.76 -54.13 17.82 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.113 -0.494 . . . . 73.530000000000001 110.903 -179.976 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 14.6 t -52.97 -28.18 22.55 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.183 -0.462 . . . . 73.329999999999998 111.141 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . 0.44 ' SD ' HD23 ' M' ' 31' ' ' LEU . 43.2 ttp -64.92 -48.35 74.45 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.239 -0.437 . . . . 74.239999999999995 110.885 179.881 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . 0.614 ' HE3' HG21 ' M' ' 35' ' ' VAL . 0.1 OUTLIER -63.34 -38.21 90.26 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.248 -0.433 . . . . 72.319999999999993 110.876 179.944 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.278 0 CA-C-N 116.268 -0.424 . . . . 65.209999999999994 111.098 179.929 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.41 HG21 HG22 ' A' ' 142' ' ' VAL . 78.8 mt . . . . . 0 C--O 1.231 0.1 0 CA-C-O 120.82 0.343 . . . . 75.140000000000001 111.109 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.79 -53.34 13.68 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.182 -0.463 . . . . 75.510000000000005 110.889 179.97 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 11.6 tt0 -51.9 -46.37 64.54 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.205 -0.452 . . . . 71.019999999999996 110.874 -179.942 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -56.18 -41.44 75.52 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.182 -0.463 . . . . 74.219999999999999 111.08 179.936 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 9.4 t80 -54.74 -36.47 64.82 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.256 -0.429 . . . . 71.430000000000007 110.863 -179.899 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.76 -47.09 64.25 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.114 -0.494 . . . . 70.019999999999996 110.86 -179.888 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 84.5 t -53.22 -28.6 15.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.204 -0.453 . . . . 71.150000000000006 111.13 179.974 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.49 ' CE1' HG11 ' A' ' 108' ' ' VAL . 9.4 m-85 -94.9 -28.2 15.32 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.149 -0.478 . . . . 71.540000000000006 110.852 -179.959 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 37.9 t0 -81.48 81.72 7.51 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.169 -0.469 . . . . 45.200000000000003 110.848 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 4.5 mptp? -76.46 -43.78 38.43 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.228 -0.442 . . . . 75.409999999999997 110.87 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 10.0 p30 -72.87 -9.14 58.36 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.215 -0.448 . . . . 63.219999999999999 110.837 179.888 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 60.34 30.67 71.77 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.717 -0.754 . . . . 73.430000000000007 112.489 -179.925 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 33.8 p-10 -82.35 -16.15 50.23 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.927 0.394 . . . . 32.340000000000003 110.922 -179.879 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 80.37 18.73 70.67 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.7 -0.762 . . . . 44.039999999999999 112.53 179.969 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 22.8 m-85 -143.52 142.56 31.18 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.859 0.361 . . . . 73.420000000000002 110.934 -179.827 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 68.5 mt -103.92 119.46 52.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.173 -0.467 . . . . 74.530000000000001 111.106 179.907 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 8.5 p -105.05 -175.42 2.79 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.132 -0.485 . . . . 63.340000000000003 110.865 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . 0.544 ' O ' HG11 ' A' ' 121' ' ' VAL . . . -74.59 -28.09 60.76 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.104 -0.498 . . . . 43.310000000000002 111.083 179.938 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -71.89 -38.34 70.01 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.229 -0.441 . . . . 72.040000000000006 111.13 179.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -74.06 -44.59 53.69 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.196 -0.457 . . . . 74.129999999999995 110.903 -179.963 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 23.3 tp -52.88 -33.74 51.43 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.162 -0.472 . . . . 55.32 110.923 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . 0.691 ' O ' HG23 ' A' ' 110' ' ' THR . 53.3 ttp85 -70.57 -44.42 67.42 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.164 -0.471 . . . . 74.219999999999999 110.905 179.914 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 2.7 t60 -54.59 -37.24 65.3 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.172 -0.467 . . . . 63.109999999999999 110.891 179.986 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.49 HG11 ' CE1' ' A' ' 92' ' ' PHE . 38.4 t -73.47 -33.18 39.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.191 -0.459 . . . . 72.120000000000005 111.123 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' MET . . . . . 0.542 ' HG3' HD12 ' A' ' 116' ' ' LEU . 15.4 mmt -70.38 -32.46 70.13 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.186 -0.461 . . . . 65.200000000000003 110.902 179.948 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . 0.691 HG23 ' O ' ' A' ' 106' ' ' ARG . 20.4 p -60.47 -43.02 97.35 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.226 -0.443 . . . . 74.109999999999999 111.161 -179.961 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 29.9 m-20 -74.66 -30.18 61.51 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.251 -0.431 . . . . 73.349999999999994 110.901 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 14.9 mt -70.69 -26.04 63.25 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.175 -0.466 . . . . 71.439999999999998 110.927 179.928 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 100.74 30.9 5.94 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.71 -0.757 . . . . 43.549999999999997 112.525 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -125.04 109.97 13.59 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.931 0.396 . . . . 64.530000000000001 110.888 -179.856 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . 0.509 ' O ' HD23 ' A' ' 116' ' ' LEU . 7.9 ptmm? -75.28 125.97 30.06 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.168 -0.469 . . . . 74.040000000000006 110.889 179.992 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.658 HD22 ' HG2' ' A' ' 120' ' ' GLU . 36.2 mt -145.12 163.35 34.58 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.201 -0.454 . . . . 72.209999999999994 110.94 179.903 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . 0.717 ' O ' HG23 ' A' ' 121' ' ' VAL . 23.7 p -118.73 173.7 6.71 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.219 -0.446 . . . . 72.129999999999995 111.101 179.971 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -58.01 -38.61 76.48 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.202 -0.454 . . . . 73.310000000000002 110.872 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 13.4 tt0 -71.96 -33.6 68.32 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.207 -0.451 . . . . 71.219999999999999 110.901 -179.92 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . 0.658 ' HG2' HD22 ' A' ' 116' ' ' LEU . 6.2 tp10 -71.1 -44.49 65.54 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.151 -0.477 . . . . 73.049999999999997 110.856 -179.951 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.717 HG23 ' O ' ' A' ' 117' ' ' THR . 39.6 t -58.93 -31.6 45.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.203 -0.453 . . . . 75.120000000000005 111.15 179.995 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -52.01 -42.3 62.92 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.172 -0.467 . . . . 64.120000000000005 110.863 179.906 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 68.4 tt0 -57.81 -31.4 66.56 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.222 -0.445 . . . . 75.519999999999996 110.908 -179.921 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 30.7 mtp -76.07 -58.76 3.09 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.101 -0.499 . . . . 53.43 110.897 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.435 HG13 ' HB2' ' A' ' 102' ' ' ALA . 35.9 mm -53.9 -35.71 28.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.215 -0.448 . . . . 73.310000000000002 111.149 179.932 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 38.8 ttt180 -63.42 -31.85 73.13 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.175 -0.466 . . . . 73.150000000000006 110.91 179.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 -74.58 -52.38 11.95 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.198 -0.456 . . . . 72.030000000000001 110.88 -179.94 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.675 ' HB3' HG22 ' A' ' 136' ' ' VAL . . . -65.34 -34.43 78.3 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.137 -0.483 . . . . 54.299999999999997 111.078 179.999 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 49.3 t0 -68.43 86.72 0.3 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.184 -0.462 . . . . 72.239999999999995 110.859 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 59.0 mt -79.82 -46.22 22.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.181 -0.463 . . . . 70.420000000000002 111.135 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 21.2 p30 -72.78 -8.69 56.65 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.202 -0.454 . . . . 71.129999999999995 110.869 179.845 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 62.79 42.71 99.64 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.738 -0.744 . . . . 64.310000000000002 112.46 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 34.7 p-10 -87.75 -15.9 35.71 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.867 0.365 . . . . 74.010000000000005 110.914 179.99 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 104.1 2.34 45.15 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.719 -0.753 . . . . 72.430000000000007 112.473 -179.941 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 4.2 tt0 -149.21 172.23 15.18 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.808 0.337 . . . . 64.400000000000006 110.921 -179.858 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 136' ' ' VAL . . . . . 0.675 HG22 ' HB3' ' A' ' 128' ' ' ALA . 98.7 t -106.91 109.98 30.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.185 -0.461 . . . . 61.420000000000002 111.132 179.913 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 20.2 p30 -90.99 165.12 13.71 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.159 -0.473 . . . . 55.109999999999999 110.885 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 34.2 t80 -52.16 -46.76 65.6 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.155 -0.475 . . . . 63.0 110.919 -179.912 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 19.0 tp10 -52.0 -40.15 60.54 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.15 -0.477 . . . . 74.209999999999994 110.835 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 22.9 mt-10 -78.4 -32.68 48.91 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.206 -0.452 . . . . 74.209999999999994 110.916 -179.935 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 65.5 t80 -67.8 -39.01 84.03 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.152 -0.476 . . . . 73.010000000000005 110.89 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . 0.41 HG22 HG21 ' A' ' 85' ' ' ILE . 95.7 t -71.25 -50.85 38.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.148 -0.478 . . . . 72.239999999999995 111.142 179.96 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 14.9 tt0 -61.32 -38.68 87.77 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.221 -0.445 . . . . 74.109999999999999 110.898 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 15.4 tpt -68.9 -55.58 10.6 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.218 -0.446 . . . . 72.319999999999993 110.862 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 12.5 ttm -60.54 -29.54 69.2 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.234 -0.439 . . . . 73.420000000000002 110.921 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 1.8 m . . . . . 0 C--N 1.33 -0.267 0 CA-C-N 116.192 -0.458 . . . . 64.450000000000003 111.143 -179.927 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' M' M ' 15' ' ' LYS . . . . . 0.433 ' HB3' ' HE3' ' A' ' 109' ' ' MET . 41.1 mttp . . . . . 0 C--O 1.23 0.078 0 CA-C-O 120.762 0.315 . . . . 71.099999999999994 110.885 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' M' M ' 16' ' ' TRP . . . . . 0.62 ' CE3' HD12 ' M' ' 19' ' ' ILE . 12.0 m95 -53.01 -40.56 63.93 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.233 -0.439 . . . . 72.450000000000003 110.912 179.96 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' M' M ' 17' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -56.35 -26.05 51.32 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.267 -0.424 . . . . 62.039999999999999 110.923 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' M' M ' 18' ' ' LYS . . . . . . . . . . . . . 29.1 tttp -78.69 -26.58 44.95 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.146 -0.479 . . . . 63.039999999999999 110.908 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' M' M ' 19' ' ' ILE . . . . . 0.62 HD12 ' CE3' ' M' ' 16' ' ' TRP . 39.3 mt -87.79 -25.18 6.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.226 -0.443 . . . . 74.549999999999997 111.1 179.88 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' M' M ' 20' ' ' ARG . . . . . . . . . . . . . 25.5 ttp180 . . . . . 0 C--N 1.329 -0.326 0 CA-C-N 116.228 -0.442 . . . . 73.439999999999998 110.864 179.962 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' M' M ' 30' ' ' LYS . . . . . . . . . . . . . 15.8 tttp . . . . . 0 C--O 1.232 0.153 0 CA-C-O 120.786 0.327 . . . . 70.209999999999994 110.859 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' M' M ' 31' ' ' LEU . . . . . 0.643 HD12 HD12 ' M' ' 34' ' ' ILE . 15.5 tp -106.77 -49.77 3.24 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.233 -0.44 . . . . 63.420000000000002 110.955 179.918 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' M' M ' 32' ' ' LYS . . . . . . . . . . . . . 39.7 tttm -48.23 -45.78 34.59 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.158 -0.473 . . . . 73.519999999999996 110.912 179.789 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' M' M ' 33' ' ' HIS . . . . . . . . . . . . . 19.8 t-160 -51.21 -39.3 56.21 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.257 -0.429 . . . . 64.109999999999999 110.88 179.881 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' M' M ' 34' ' ' ILE . . . . . 0.643 HD12 HD12 ' M' ' 31' ' ' LEU . 72.5 mt -51.18 -37.78 18.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.196 -0.456 . . . . 64.450000000000003 111.186 179.982 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' M' M ' 35' ' ' VAL . . . . . 0.614 HG21 ' HE3' ' A' ' 72' ' ' MET . 46.3 t -49.11 -39.11 12.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.157 -0.474 . . . . 64.450000000000003 111.133 179.86 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' M' M ' 36' ' ' TRP . . . . . . . . . . . . . 19.5 m0 -58.44 -40.03 81.47 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.154 -0.475 . . . . 74.25 110.892 179.967 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' M' M ' 37' ' ' ALA . . . . . 1.004 ' HB3' HD13 ' A' ' 39' ' ' LEU . . . -63.2 -18.7 63.78 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.191 -0.459 . . . . 75.310000000000002 111.097 179.931 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' M' M ' 38' ' ' SER . . . . . . . . . . . . . 1.5 m -68.24 -18.07 64.46 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.185 -0.462 . . . . 70.450000000000003 110.853 -179.727 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' M' M ' 39' ' ' ARG . . . . . . . . . . . . . 41.2 mtp180 -52.49 -29.56 25.54 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.087 -0.506 . . . . 43.229999999999997 110.862 -179.946 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' M' M ' 40' ' ' GLU . . . . . . . . . . . . . 21.7 mt-10 -82.06 -48.05 11.87 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.178 -0.465 . . . . 64.349999999999994 110.892 -179.915 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' M' M ' 41' ' ' LEU . . . . . 0.562 HD21 ' OG ' ' A' ' 38' ' ' SER . 9.8 mt . . . . . 0 C--N 1.329 -0.3 0 CA-C-N 116.184 -0.462 . . . . 72.340000000000003 110.929 179.998 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 35.0 tt0 . . . . . 0 C--O 1.232 0.143 0 CA-C-O 120.746 0.308 . . . . 63.219999999999999 110.878 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 62.1 mt -72.53 -37.68 57.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.246 -0.434 . . . . 73.239999999999995 111.143 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -56.03 -45.23 79.23 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.115 -0.493 . . . . 62.149999999999999 111.082 179.872 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -66.44 -32.2 73.42 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.2 -0.455 . . . . 64.239999999999995 110.921 -179.958 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.413 ' HB3' HD13 ' A' ' 69' ' ' LEU . 9.4 m-85 -73.44 -45.93 51.44 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.119 -0.491 . . . . 63.43 110.888 -179.95 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 34.9 ttmt -56.76 -37.61 71.29 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.172 -0.467 . . . . 63.420000000000002 110.907 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -59.92 -30.69 69.22 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.272 -0.422 . . . . 75.540000000000006 110.891 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -67.26 -42.39 83.97 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.174 -0.466 . . . . 63.219999999999999 111.119 179.933 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 40.8 t80 -58.16 -54.13 50.39 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.238 -0.437 . . . . 65.329999999999998 110.891 -179.928 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 6.8 t -52.26 -31.09 30.84 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.146 -0.479 . . . . 75.239999999999995 110.833 -179.814 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 16.2 tp -65.74 -49.34 68.78 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.187 -0.461 . . . . 71.239999999999995 110.919 179.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.826 ' HA ' HG21 ' A' ' 35' ' ' VAL . 33.1 m-85 -72.28 -25.97 61.8 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.178 -0.464 . . . . 75.519999999999996 110.853 179.96 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 13.5 t0 -86.05 98.53 10.9 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.163 -0.472 . . . . 64.439999999999998 110.901 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 6.7 tppt? -68.96 -52.78 25.42 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.23 -0.441 . . . . 71.340000000000003 110.869 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 24.1 p-10 -77.08 -10.08 59.15 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.241 -0.436 . . . . 75.310000000000002 110.913 179.861 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 52.11 48.4 52.77 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.773 -0.727 . . . . 64.099999999999994 112.433 -179.978 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 31.8 p-10 -88.53 -15.71 34.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.818 0.342 . . . . 74.340000000000003 110.889 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 105.41 -11.64 47.25 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.718 -0.753 . . . . 72.299999999999997 112.5 -179.925 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 4.2 p -132.13 130.7 41.5 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.712 0.292 . . . . 72.310000000000002 111.151 -179.873 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.487 HG22 ' HB2' ' A' ' 32' ' ' LEU . 23.2 mt -89.7 114.01 26.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.239 -0.437 . . . . 64.25 111.117 179.906 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.583 HG22 HG21 ' A' ' 62' ' ' THR . 44.8 p -93.38 170.67 9.44 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.216 -0.447 . . . . 74.530000000000001 111.113 179.957 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.584 HG22 HD12 ' A' ' 52' ' ' ILE . 82.4 p -58.17 -34.47 70.35 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.213 -0.449 . . . . 72.25 111.119 -179.955 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 30.8 tptt -79.84 -50.13 10.96 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.213 -0.448 . . . . 74.340000000000003 110.922 179.882 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.53 ' OE1' HG23 ' A' ' 28' ' ' THR . 60.1 mt-10 -59.03 -34.69 72.2 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.189 -0.46 . . . . 72.409999999999997 110.928 179.931 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.487 ' HB2' HG22 ' A' ' 27' ' ' ILE . 4.1 tt -74.22 -55.68 5.78 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.138 -0.483 . . . . 73.5 110.894 -179.986 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -52.3 -27.87 25.64 Favored Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.752 -0.737 . . . . 73.340000000000003 112.485 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 96.3 m -58.5 -58.06 10.2 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.838 0.352 . . . . 61.229999999999997 111.131 -179.821 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.826 HG21 ' HA ' ' A' ' 19' ' ' PHE . 98.7 t -56.21 -47.55 80.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.225 -0.443 . . . . 72.230000000000004 111.084 179.933 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 7.0 mtp -51.86 -41.36 61.8 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.201 -0.454 . . . . 72.030000000000001 110.879 179.897 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 27.9 ttt180 -53.09 -45.44 68.2 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.244 -0.435 . . . . 65.430000000000007 110.829 -179.896 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . 0.655 ' OG ' HD11 ' M' ' 41' ' ' LEU . 1.8 p -61.25 -26.14 67.55 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.247 -0.433 . . . . 64.340000000000003 110.843 -179.739 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.996 HD13 ' HB3' ' M' ' 37' ' ' ALA . 18.0 mt -89.86 -16.35 30.27 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.163 -0.472 . . . . 72.450000000000003 110.889 -180.0 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 101.44 27.34 7.26 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.725 -0.75 . . . . 64.420000000000002 112.467 179.853 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 22.0 mm100 -116.88 106.5 13.52 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.78 0.324 . . . . 61.25 110.901 -179.916 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 14.6 t-20 -109.99 76.56 1.0 Allowed Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 121.637 0.732 . . . . 74.209999999999994 110.865 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.75 168.09 22.55 Favored 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.656 2.237 . . . . 72.310000000000002 112.334 179.925 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 19.0 p -87.6 156.67 19.39 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.195 -0.457 . . . . 63.130000000000003 111.162 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -51.8 -41.77 61.96 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.205 -0.452 . . . . 61.32 110.893 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.23 -32.16 64.58 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.187 -0.46 . . . . 71.439999999999998 111.098 179.901 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 68.3 tt0 -68.86 -50.08 52.83 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.222 -0.445 . . . . 64.230000000000004 110.915 -179.887 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 16.0 mt -55.12 -45.24 75.54 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.087 -0.506 . . . . 64.239999999999995 110.922 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 3.8 tm0? -71.77 -28.68 63.8 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.166 -0.47 . . . . 73.109999999999999 110.895 179.917 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -63.71 -49.76 71.82 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.231 -0.44 . . . . 74.450000000000003 110.901 179.946 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 5.5 ptp -66.2 -37.47 85.68 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.19 -0.459 . . . . 62.329999999999998 110.872 179.988 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.584 HD12 HG22 ' A' ' 29' ' ' THR . 66.0 mt -67.07 -38.1 80.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.203 -0.453 . . . . 72.409999999999997 111.059 -179.958 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 14.3 m-20 -59.58 -37.63 79.05 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.231 -0.44 . . . . 75.299999999999997 110.881 179.935 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 70.0 mm-40 -61.98 -47.95 82.52 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.196 -0.456 . . . . 61.409999999999997 110.897 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 16.9 m -77.81 -15.24 14.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.141 -0.482 . . . . 62.130000000000003 111.099 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 37.3 t0 -66.8 94.26 0.3 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.223 -0.444 . . . . 72.450000000000003 110.861 179.929 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.27 -35.92 16.99 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.182 -0.463 . . . . 53.219999999999999 111.11 179.945 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 1.9 p-10 -88.67 -0.17 57.02 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.235 -0.439 . . . . 70.140000000000001 110.867 179.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 54.5 60.09 9.12 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.746 -0.74 . . . . 61.109999999999999 112.5 -179.913 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 50.9 p-10 -114.6 -15.79 11.94 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.912 0.386 . . . . 72.439999999999998 110.91 -179.921 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 93.4 13.26 56.06 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.771 -0.728 . . . . 53.130000000000003 112.504 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . 0.583 HG21 HG22 ' A' ' 28' ' ' THR . 70.3 p -150.65 171.93 16.36 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.732 0.301 . . . . 75.5 111.157 -179.88 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 16.1 mt -96.1 115.17 34.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.223 -0.444 . . . . 73.430000000000007 111.1 179.947 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.7 t0 -78.78 -175.26 4.35 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.18 -0.464 . . . . 61.350000000000001 110.884 179.866 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.531 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 2.5 t80 -63.5 -58.37 15.75 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.634 0.73 . . . . 72.129999999999995 110.898 -179.888 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . 0.531 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 53.6 Cg_endo -69.79 -30.64 21.82 Favored 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.624 2.216 . . . . 74.239999999999995 112.343 -179.994 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 55.8 mt-10 -59.0 -40.77 85.91 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.268 -0.424 . . . . 71.329999999999998 110.909 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 12.7 t80 -74.17 -35.68 64.02 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.171 -0.468 . . . . 73.409999999999997 110.911 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.413 HD13 ' HB3' ' A' ' 12' ' ' PHE . 27.6 tp -68.4 -53.88 20.86 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.141 -0.482 . . . . 43.210000000000001 110.937 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 15.3 t -53.63 -29.17 36.88 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.184 -0.462 . . . . 61.119999999999997 111.133 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . 0.495 ' HE3' HD11 ' M' ' 31' ' ' LEU . 35.4 ttp -62.78 -43.49 98.66 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.237 -0.438 . . . . 70.400000000000006 110.856 179.964 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . 0.585 ' HE3' HG11 ' M' ' 35' ' ' VAL . 3.3 mmt -71.4 -29.72 65.25 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.236 -0.438 . . . . 71.310000000000002 110.9 179.927 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.309 0 CA-C-N 116.226 -0.443 . . . . 62.509999999999998 111.136 179.915 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.458 HG21 ' HA ' ' A' ' 142' ' ' VAL . 70.6 mt . . . . . 0 C--O 1.232 0.142 0 CA-C-O 120.813 0.34 . . . . 75.439999999999998 111.181 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 45.7 ttp180 -62.5 -28.32 69.75 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.176 -0.465 . . . . 64.120000000000005 110.924 179.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.73 ' O ' HG23 ' A' ' 91' ' ' VAL . 10.0 mm-40 -76.13 -46.87 26.63 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.207 -0.451 . . . . 73.510000000000005 110.922 179.983 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . 0.628 ' HB1' ' CE2' ' A' ' 92' ' ' PHE . . . -63.75 -42.68 97.8 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.171 -0.468 . . . . 74.25 111.1 179.924 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 9.9 t80 -52.02 -50.69 60.9 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.211 -0.45 . . . . 74.319999999999993 110.88 -179.905 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 32.1 ttm180 -62.75 -35.98 81.56 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.141 -0.481 . . . . 73.230000000000004 110.858 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . 0.73 HG23 ' O ' ' A' ' 87' ' ' GLU . 85.3 t -63.91 -42.67 96.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.186 -0.461 . . . . 73.109999999999999 111.134 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.628 ' CE2' ' HB1' ' A' ' 88' ' ' ALA . 9.2 m-85 -78.2 -31.18 49.31 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.157 -0.474 . . . . 75.439999999999998 110.899 -179.983 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 22.7 t0 -61.25 96.91 0.06 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.168 -0.469 . . . . 75.450000000000003 110.894 179.98 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 13.4 mmmt -77.35 -53.34 7.8 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.23 -0.441 . . . . 61.140000000000001 110.872 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 16.5 p30 -74.25 -9.19 58.36 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.226 -0.443 . . . . 64.549999999999997 110.838 179.902 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 59.69 25.86 61.78 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.75 -0.738 . . . . 54.100000000000001 112.465 -179.917 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 40.5 p-10 -82.11 -16.16 50.91 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.824 0.345 . . . . 73.450000000000003 110.901 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 86.7 18.7 57.93 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.735 -0.745 . . . . 73.219999999999999 112.485 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 13.0 m-85 -137.85 134.27 34.9 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.888 0.375 . . . . 73.109999999999999 110.933 -179.816 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 71.4 mt -100.04 125.6 53.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.098 -0.501 . . . . 51.520000000000003 111.102 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 86.0 p -109.17 -172.81 2.12 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.198 -0.455 . . . . 63.140000000000001 110.885 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . 0.517 ' HB1' ' CG1' ' A' ' 121' ' ' VAL . . . -72.74 -37.11 67.81 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.114 -0.494 . . . . 52.439999999999998 111.074 179.883 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -70.24 -49.92 45.1 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.238 -0.437 . . . . 51.200000000000003 111.101 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -62.56 -48.5 79.19 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.227 -0.442 . . . . 75.430000000000007 110.867 -179.911 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.44 HD11 ' CD1' ' M' ' 19' ' ' ILE . 30.4 tp -56.35 -26.85 54.06 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.169 -0.468 . . . . 74.400000000000006 110.904 -179.933 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . 0.451 ' O ' HG23 ' A' ' 110' ' ' THR . 17.9 ttm180 -73.35 -29.04 62.39 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.175 -0.466 . . . . 63.219999999999999 110.875 179.938 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 19.8 t60 -66.95 -34.69 78.32 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.191 -0.459 . . . . 73.099999999999994 110.871 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 40.9 t -74.49 -39.58 47.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.17 -0.468 . . . . 72.319999999999993 111.168 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 2.3 mmt -73.87 -38.69 64.34 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.164 -0.471 . . . . 61.549999999999997 110.913 179.857 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . 0.451 HG23 ' O ' ' A' ' 106' ' ' ARG . 3.0 p -54.12 -32.75 56.0 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.209 -0.45 . . . . 74.430000000000007 111.165 -179.935 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -74.68 -28.35 60.79 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.218 -0.446 . . . . 74.019999999999996 110.887 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -70.68 -25.95 63.21 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.19 -0.459 . . . . 74.129999999999995 110.933 179.947 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 100.84 19.4 17.51 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.73 -0.748 . . . . 52.43 112.518 179.93 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -102.81 127.9 49.79 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.873 0.368 . . . . 73.400000000000006 110.896 -179.874 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 34.0 mttp -80.83 117.51 21.55 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.186 -0.461 . . . . 73.319999999999993 110.929 179.945 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 15.3 mt -130.02 113.34 14.44 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.253 -0.43 . . . . 75.030000000000001 110.909 179.933 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . 0.588 ' O ' HG23 ' A' ' 121' ' ' VAL . 75.1 p -81.91 171.22 14.71 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.17 -0.468 . . . . 71.120000000000005 111.156 179.932 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 46.7 m-20 -52.01 -36.68 50.78 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.238 -0.437 . . . . 74.040000000000006 110.826 179.9 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -75.23 -33.4 61.35 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.163 -0.471 . . . . 73.109999999999999 110.928 -179.91 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -69.63 -42.19 74.62 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.111 -0.495 . . . . 64.140000000000001 110.906 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.588 HG23 ' O ' ' A' ' 117' ' ' THR . 21.8 t -61.03 -38.62 79.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.163 -0.471 . . . . 72.120000000000005 111.119 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 50.0 t0 -56.88 -45.48 82.49 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.212 -0.449 . . . . 65.510000000000005 110.9 179.901 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 15.5 tm-20 -57.51 -34.26 68.91 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.193 -0.458 . . . . 73.319999999999993 110.839 -179.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . 0.406 ' HE2' ' HG3' ' M' ' 15' ' ' LYS . 27.1 mtp -70.69 -59.56 2.75 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.2 -0.454 . . . . 62.329999999999998 110.862 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.45 HG13 ' HB2' ' A' ' 102' ' ' ALA . 36.3 mm -53.97 -35.5 28.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.211 -0.449 . . . . 74.310000000000002 111.134 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 56.5 ttt85 -63.07 -31.84 73.08 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.171 -0.468 . . . . 75.549999999999997 110.863 179.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -75.11 -52.38 11.14 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.148 -0.478 . . . . 64.019999999999996 110.9 -179.959 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.659 ' HB3' HG22 ' A' ' 136' ' ' VAL . . . -64.88 -34.41 78.32 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.168 -0.469 . . . . 73.25 111.126 179.909 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 49.0 t0 -68.37 86.9 0.29 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.197 -0.456 . . . . 74.099999999999994 110.853 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 64.7 mt -79.85 -46.61 22.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.178 -0.465 . . . . 74.120000000000005 111.145 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 21.5 p30 -72.63 -8.69 56.53 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.175 -0.466 . . . . 74.519999999999996 110.865 179.848 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 62.86 43.02 99.54 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.73 -0.748 . . . . 44.32 112.497 -179.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 34.5 p-10 -88.51 -15.91 34.05 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.865 0.364 . . . . 52.020000000000003 110.869 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 104.14 2.35 45.03 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.768 -0.729 . . . . 64.150000000000006 112.468 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 5.3 tt0 -149.21 172.29 15.08 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.814 0.34 . . . . 61.219999999999999 110.913 -179.902 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 136' ' ' VAL . . . . . 0.659 HG22 ' HB3' ' A' ' 128' ' ' ALA . 72.4 t -106.83 109.28 27.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.185 -0.462 . . . . 62.219999999999999 111.111 179.977 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 20.9 p30 -91.27 164.79 13.75 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.159 -0.473 . . . . 50.240000000000002 110.859 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 138' ' ' TYR . . . . . 0.583 ' O ' HG23 ' A' ' 142' ' ' VAL . 37.5 t80 -52.25 -46.22 65.68 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.185 -0.462 . . . . 65.409999999999997 110.923 -179.97 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -51.91 -39.74 59.58 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.117 -0.492 . . . . 72.239999999999995 110.868 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 26.1 mt-10 -78.38 -37.36 44.32 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.172 -0.467 . . . . 52.530000000000001 110.887 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 36.8 t80 -63.95 -39.61 94.55 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.135 -0.484 . . . . 64.409999999999997 110.855 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . 0.583 HG23 ' O ' ' A' ' 138' ' ' TYR . 90.9 t -63.74 -50.72 76.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.175 -0.466 . . . . 61.0 111.119 -179.996 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . 0.548 ' HA ' HG22 ' A' ' 146' ' ' THR . 43.3 tt0 -70.8 -23.38 62.36 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.181 -0.463 . . . . 73.230000000000004 110.927 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 11.7 tpt -75.03 -18.73 60.29 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.157 -0.474 . . . . 72.200000000000003 110.904 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 145' ' ' MET . . . . . 0.499 ' HE2' ' HA ' ' M' ' 20' ' ' ARG . 5.8 ttm -98.2 -32.98 11.3 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.225 -0.443 . . . . 72.019999999999996 110.856 179.954 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 146' ' ' THR . . . . . 0.548 HG22 ' HA ' ' A' ' 143' ' ' GLN . 5.0 t . . . . . 0 C--N 1.329 -0.291 0 CA-C-N 116.256 -0.429 . . . . 35.210000000000001 111.128 -179.918 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' M' M ' 15' ' ' LYS . . . . . 0.406 ' HG3' ' HE2' ' A' ' 124' ' ' MET . 0.4 OUTLIER . . . . . 0 C--O 1.231 0.083 0 CA-C-O 120.815 0.341 . . . . 74.219999999999999 110.939 . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' M' M ' 16' ' ' TRP . . . . . 0.581 ' CZ3' HD12 ' M' ' 19' ' ' ILE . 3.1 m95 -51.94 -38.59 57.04 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.222 -0.445 . . . . 72.540000000000006 110.865 179.908 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' M' M ' 17' ' ' GLU . . . . . . . . . . . . . 58.4 tt0 -56.07 -30.91 62.68 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.251 -0.431 . . . . 73.209999999999994 110.944 -179.959 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' M' M ' 18' ' ' LYS . . . . . . . . . . . . . 6.5 tppt? -52.02 -30.41 25.28 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.13 -0.486 . . . . 72.519999999999996 110.892 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' M' M ' 19' ' ' ILE . . . . . 0.581 HD12 ' CZ3' ' M' ' 16' ' ' TRP . 64.1 mt -91.31 -24.54 5.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.167 -0.47 . . . . 74.200000000000003 111.088 179.901 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' M' M ' 20' ' ' ARG . . . . . 0.499 ' HA ' ' HE2' ' A' ' 145' ' ' MET . 12.1 ttm180 . . . . . 0 C--N 1.329 -0.288 0 CA-C-N 116.204 -0.453 . . . . 72.099999999999994 110.835 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' M' M ' 30' ' ' LYS . . . . . . . . . . . . . 14.5 mtmm . . . . . 0 C--O 1.231 0.129 0 CA-C-O 120.817 0.341 . . . . 73.310000000000002 110.889 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' M' M ' 31' ' ' LEU . . . . . 0.495 HD11 ' HE3' ' A' ' 71' ' ' MET . 0.8 OUTLIER -96.99 -28.05 14.34 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.247 -0.433 . . . . 72.349999999999994 110.909 179.927 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' M' M ' 32' ' ' LYS . . . . . . . . . . . . . 7.5 tttp -49.2 -46.42 45.67 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.205 -0.452 . . . . 65.450000000000003 110.889 179.825 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' M' M ' 33' ' ' HIS . . . . . . . . . . . . . 22.1 t-160 -50.95 -37.18 42.87 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.239 -0.437 . . . . 72.239999999999995 110.842 179.91 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' M' M ' 34' ' ' ILE . . . . . . . . . . . . . 47.6 mm -50.33 -39.57 17.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.221 -0.445 . . . . 75.0 111.157 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' M' M ' 35' ' ' VAL . . . . . 0.585 HG11 ' HE3' ' A' ' 72' ' ' MET . 46.9 t -48.86 -40.18 12.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.131 -0.486 . . . . 72.140000000000001 111.132 179.818 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' M' M ' 36' ' ' TRP . . . . . . . . . . . . . 23.6 m0 -58.62 -39.91 81.82 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.177 -0.465 . . . . 74.319999999999993 110.956 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' M' M ' 37' ' ' ALA . . . . . 0.996 ' HB3' HD13 ' A' ' 39' ' ' LEU . . . -63.69 -18.66 64.21 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.198 -0.455 . . . . 73.230000000000004 111.141 179.845 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' M' M ' 38' ' ' SER . . . . . . . . . . . . . 13.2 m -69.48 -17.95 63.66 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.199 -0.455 . . . . 65.099999999999994 110.876 -179.811 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' M' M ' 39' ' ' ARG . . . . . . . . . . . . . 25.8 mmm180 -63.11 -24.18 67.78 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.122 -0.49 . . . . 73.430000000000007 110.831 -179.916 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' M' M ' 40' ' ' GLU . . . . . . . . . . . . . 17.3 tt0 -80.72 -48.07 13.07 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.212 -0.449 . . . . 73.400000000000006 110.905 -179.946 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' M' M ' 41' ' ' LEU . . . . . 0.655 HD11 ' OG ' ' A' ' 38' ' ' SER . 19.7 mt . . . . . 0 C--N 1.328 -0.336 0 CA-C-N 116.168 -0.469 . . . . 74.299999999999997 110.913 -179.992 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 28.5 tp60 . . . . . 0 C--O 1.231 0.112 0 CA-C-O 120.787 0.327 . . . . 73.120000000000005 110.915 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 54.3 mt -69.16 -37.25 76.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.205 -0.452 . . . . 60.520000000000003 111.114 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -51.95 -39.06 58.65 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.161 -0.472 . . . . 73.340000000000003 111.12 179.796 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 56.8 mt-10 -72.64 -52.03 17.06 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.234 -0.439 . . . . 73.420000000000002 110.89 -179.917 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.531 ' HB3' HD13 ' A' ' 69' ' ' LEU . 30.4 m-85 -55.96 -39.6 71.99 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.151 -0.477 . . . . 74.319999999999993 110.861 -179.913 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.14 -31.35 65.25 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.109 -0.496 . . . . 43.130000000000003 110.883 -179.985 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 24.4 tt0 -72.27 -30.71 65.11 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.231 -0.44 . . . . 63.32 110.879 179.966 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -72.77 -35.04 67.35 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.162 -0.472 . . . . 65.230000000000004 111.115 179.92 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 91.5 t80 -75.63 -51.99 11.58 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.213 -0.449 . . . . 73.319999999999993 110.87 -179.874 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 14.8 t -52.03 -31.79 31.42 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.158 -0.474 . . . . 75.450000000000003 110.845 -179.79 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.533 HD23 ' HB3' ' M' ' 38' ' ' SER . 15.9 tp -64.05 -47.11 81.46 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.071 -0.513 . . . . 65.019999999999996 110.911 -179.954 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.566 ' CD1' HG11 ' A' ' 35' ' ' VAL . 17.2 m-85 -69.79 -24.82 63.55 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.183 -0.462 . . . . 73.400000000000006 110.848 179.972 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 21.2 t0 -86.59 98.58 11.17 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.184 -0.462 . . . . 71.040000000000006 110.812 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.763 ' HE2' HG22 ' A' ' 35' ' ' VAL . 5.0 mptp? -71.23 -55.51 7.95 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.166 -0.47 . . . . 62.229999999999997 110.85 -179.99 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 23.1 p-10 -71.12 -10.25 59.43 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.249 -0.432 . . . . 71.510000000000005 110.833 179.892 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 51.49 40.6 47.21 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.746 -0.74 . . . . 54.219999999999999 112.522 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 21.1 p-10 -88.31 -15.7 35.04 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.878 0.37 . . . . 74.319999999999993 110.909 -179.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 104.64 -11.69 50.17 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.72 -0.752 . . . . 73.230000000000004 112.518 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 5.0 p -129.05 130.67 46.86 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.739 0.305 . . . . 44.520000000000003 111.182 -179.896 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 24.8 mt -96.83 128.64 47.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.244 -0.434 . . . . 74.510000000000005 111.149 179.933 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 32.2 p -108.31 -177.5 3.34 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.159 -0.473 . . . . 73.510000000000005 111.187 179.945 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.41 ' HB ' HD13 ' A' ' 48' ' ' LEU . 39.2 p -64.6 -37.32 87.15 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.259 -0.428 . . . . 73.349999999999994 111.141 -179.958 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 6.0 mmmm -71.99 -49.92 33.12 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.176 -0.466 . . . . 63.130000000000003 110.894 179.891 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 68.8 mt-10 -60.47 -36.61 78.67 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.212 -0.449 . . . . 75.439999999999998 110.879 179.985 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.2 tt -74.28 -55.63 5.81 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.131 -0.486 . . . . 75.340000000000003 110.931 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -52.08 -28.03 24.4 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.76 -0.734 . . . . 24.100000000000001 112.479 179.878 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 95.8 m -65.76 -54.51 26.14 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.767 0.318 . . . . 60.140000000000001 111.146 -179.889 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.763 HG22 ' HE2' ' A' ' 21' ' ' LYS . 42.7 t -55.98 -50.22 70.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.275 -0.421 . . . . 71.549999999999997 111.107 179.926 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -51.99 -38.06 55.37 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.177 -0.465 . . . . 64.120000000000005 110.853 179.915 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 32.7 ttm-85 -53.5 -52.89 58.12 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.277 -0.42 . . . . 74.439999999999998 110.872 -179.903 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . 0.59 ' OG ' HD21 ' M' ' 41' ' ' LEU . 3.1 t -64.76 -26.56 68.41 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.199 -0.455 . . . . 54.200000000000003 110.864 -179.826 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.98 HD13 ' HB3' ' M' ' 37' ' ' ALA . 61.9 mt -79.45 -18.6 51.78 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.152 -0.477 . . . . 72.030000000000001 110.958 -179.994 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 101.45 28.24 6.83 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.746 -0.74 . . . . 53.530000000000001 112.458 179.88 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 48.4 mm-40 -125.09 129.88 51.12 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.819 0.342 . . . . 60.109999999999999 110.908 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 39.2 t30 -109.86 80.02 1.61 Allowed Pre-proline 0 C--N 1.33 -0.28 0 CA-C-O 121.602 0.715 . . . . 72.319999999999993 110.896 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.7 147.94 64.37 Favored 'Trans proline' 0 C--O 1.231 0.174 0 C-N-CA 122.724 2.283 . . . . 75.0 112.346 179.913 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 21.3 p -96.01 162.56 13.5 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.209 -0.45 . . . . 72.540000000000006 111.189 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 20.7 tt0 -55.28 -44.39 75.61 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.26 -0.427 . . . . 74.430000000000007 110.846 -179.951 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.25 -31.73 64.28 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.186 -0.461 . . . . 53.039999999999999 111.094 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 78.4 tt0 -66.46 -49.29 67.16 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.246 -0.434 . . . . 75.099999999999994 110.92 -179.95 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.41 HD13 ' HB ' ' A' ' 29' ' ' THR . 14.8 mt -55.15 -51.68 65.7 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.158 -0.474 . . . . 70.019999999999996 110.95 -179.991 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 15.9 tp60 -55.01 -28.93 55.84 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.196 -0.456 . . . . 65.439999999999998 110.933 179.92 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -72.89 -40.05 65.9 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.182 -0.463 . . . . 73.219999999999999 110.825 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 38.2 mtp -76.36 -25.26 54.46 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.206 -0.452 . . . . 61.539999999999999 110.868 -179.995 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 80.3 mt -79.67 -40.64 21.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.259 -0.428 . . . . 72.420000000000002 111.14 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 49.2 m-20 -60.16 -48.8 80.21 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.178 -0.464 . . . . 62.009999999999998 110.905 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 18.0 pt-20 -55.7 -27.07 48.36 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.121 -0.49 . . . . 62.399999999999999 110.911 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.584 HG11 HD23 ' M' ' 31' ' ' LEU . 32.4 m -108.34 11.71 8.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.151 -0.477 . . . . 63.100000000000001 111.166 179.955 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 26.9 t0 -90.03 98.13 11.59 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.149 -0.478 . . . . 45.420000000000002 110.863 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.28 -46.25 9.37 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.206 -0.452 . . . . 63.020000000000003 111.13 179.931 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 10.2 p-10 -81.66 -0.19 41.49 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.196 -0.456 . . . . 75.019999999999996 110.863 179.96 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 53.65 56.5 19.93 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.718 -0.753 . . . . 53.229999999999997 112.508 -179.928 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 49.6 p-10 -114.51 -15.82 11.98 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.845 0.355 . . . . 73.430000000000007 110.861 -179.857 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 91.93 17.41 47.9 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.755 -0.736 . . . . 72.340000000000003 112.477 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 20.4 p -145.54 168.37 20.76 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.793 0.33 . . . . 73.430000000000007 111.11 -179.876 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 16.9 mt -106.72 109.49 28.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.163 -0.471 . . . . 60.109999999999999 111.133 179.927 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -76.9 -172.97 2.5 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.167 -0.469 . . . . 70.340000000000003 110.852 179.864 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.535 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 2.5 t80 -65.58 -58.43 11.77 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-O 121.667 0.746 . . . . 73.150000000000006 110.92 -179.936 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . 0.535 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 54.2 Cg_endo -69.75 -24.98 29.11 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.658 2.239 . . . . 73.120000000000005 112.365 179.949 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 22.7 mt-10 -63.66 -40.67 97.41 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.237 -0.438 . . . . 63.5 110.914 -179.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 34.3 t80 -74.02 -36.28 64.45 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.161 -0.472 . . . . 64.310000000000002 110.883 -179.945 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.531 HD13 ' HB3' ' A' ' 12' ' ' PHE . 50.1 tp -70.64 -53.9 14.03 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.171 -0.468 . . . . 72.019999999999996 110.949 179.981 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 13.1 t -55.64 -26.55 45.01 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.178 -0.465 . . . . 73.549999999999997 111.126 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 9.1 tmm? -62.83 -39.61 94.84 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.197 -0.456 . . . . 64.120000000000005 110.892 179.913 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -79.76 -40.02 29.7 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.22 -0.445 . . . . 72.310000000000002 110.938 179.918 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.287 0 CA-C-N 116.184 -0.462 . . . . 74.239999999999995 111.085 179.9 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.753 HG21 HG22 ' A' ' 142' ' ' VAL . 3.1 mp . . . . . 0 C--O 1.231 0.094 0 CA-C-O 120.861 0.362 . . . . 70.310000000000002 111.148 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 41.8 ttm-85 -54.69 -28.15 45.58 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.151 -0.477 . . . . 74.010000000000005 110.885 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.726 ' O ' HG23 ' A' ' 91' ' ' VAL . 7.9 tm-20 -74.94 -58.52 3.23 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.177 -0.465 . . . . 71.400000000000006 110.866 -179.948 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . 0.74 ' HB1' ' CE2' ' A' ' 92' ' ' PHE . . . -58.83 -43.31 90.63 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.177 -0.465 . . . . 64.230000000000004 111.129 179.922 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 4.1 t80 -52.01 -48.11 64.63 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.166 -0.47 . . . . 64.540000000000006 110.925 -179.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.22 -26.19 64.68 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.13 -0.486 . . . . 72.299999999999997 110.905 -179.95 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . 0.726 HG23 ' O ' ' A' ' 87' ' ' GLU . 93.0 t -77.36 -27.31 15.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.16 -0.473 . . . . 61.219999999999999 111.133 179.974 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.74 ' CE2' ' HB1' ' A' ' 88' ' ' ALA . 18.2 m-85 -94.77 -28.48 15.25 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.174 -0.466 . . . . 75.540000000000006 110.872 -179.946 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 34.6 t0 -66.9 95.86 0.39 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.12 -0.491 . . . . 74.519999999999996 110.888 179.981 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 71.1 mmtt -78.73 -52.26 8.63 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.201 -0.454 . . . . 55.140000000000001 110.899 179.997 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 10.2 p30 -72.32 -9.2 58.18 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.193 -0.458 . . . . 74.299999999999997 110.838 179.886 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 59.19 26.22 61.07 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.733 -0.746 . . . . 72.200000000000003 112.518 -179.923 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 35.7 p-10 -81.75 -16.16 51.99 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.91 0.386 . . . . 74.340000000000003 110.895 -179.878 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 87.05 18.71 57.34 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.742 -0.742 . . . . 70.400000000000006 112.506 -179.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 19.7 m-85 -141.96 146.55 35.76 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.834 0.349 . . . . 72.209999999999994 110.948 -179.791 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.556 HD12 ' CD2' ' A' ' 141' ' ' PHE . 62.1 mt -112.89 127.47 70.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.108 -0.496 . . . . 74.030000000000001 111.178 179.87 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 96.3 p -112.75 -172.59 2.08 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.163 -0.471 . . . . 73.439999999999998 110.835 -179.876 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . 0.472 ' O ' HG11 ' A' ' 121' ' ' VAL . . . -65.4 -34.14 77.61 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.129 -0.487 . . . . 70.310000000000002 111.095 179.914 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -70.4 -49.89 44.27 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.213 -0.449 . . . . 53.439999999999998 111.064 179.934 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . 0.53 ' O ' HG23 ' A' ' 108' ' ' VAL . 21.5 mt-10 -62.24 -50.21 72.67 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.243 -0.435 . . . . 73.120000000000005 110.853 -179.875 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.456 HD21 ' HB3' ' A' ' 124' ' ' MET . 12.0 tp -53.6 -52.46 59.73 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.151 -0.477 . . . . 62.240000000000002 110.946 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . 0.489 ' HB2' HG21 ' A' ' 121' ' ' VAL . 31.9 ttp180 -57.34 -42.29 81.69 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.158 -0.474 . . . . 64.230000000000004 110.855 179.949 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 50.3 t60 -60.34 -34.42 73.81 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.249 -0.432 . . . . 62.32 110.903 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.53 HG23 ' O ' ' A' ' 104' ' ' GLU . 95.8 t -71.53 -52.47 25.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.188 -0.46 . . . . 61.140000000000001 111.087 179.996 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' MET . . . . . 0.688 ' HE3' ' HB3' ' M' ' 15' ' ' LYS . 5.6 tpp -62.69 -42.03 99.42 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.174 -0.467 . . . . 63.340000000000003 110.882 179.929 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . 0.452 HG23 ' O ' ' A' ' 106' ' ' ARG . 12.8 p -53.84 -36.62 62.77 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.255 -0.429 . . . . 63.119999999999997 111.138 -179.933 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 87.9 m-20 -61.13 -30.24 70.25 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.248 -0.433 . . . . 64.129999999999995 110.893 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.745 HD13 ' HD3' ' M' ' 18' ' ' LYS . 23.5 mt -70.75 -23.38 62.42 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.168 -0.469 . . . . 72.439999999999998 110.914 179.988 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 101.02 32.98 5.12 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.77 -0.729 . . . . 54.5 112.509 179.901 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 34.9 tp10 -111.65 111.02 21.72 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.934 0.397 . . . . 71.409999999999997 110.922 -179.905 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 5.8 ptpp? -60.67 127.79 33.41 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.116 -0.493 . . . . 71.420000000000002 110.845 -179.985 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.468 HD21 ' HD3' ' M' ' 15' ' ' LYS . 30.5 mt -146.75 162.5 38.42 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.235 -0.438 . . . . 74.010000000000005 110.928 179.895 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 33.1 p -118.68 159.87 22.87 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.167 -0.47 . . . . 74.540000000000006 111.177 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -52.24 -39.58 60.49 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.217 -0.447 . . . . 71.340000000000003 110.857 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -72.48 -33.37 66.94 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.187 -0.46 . . . . 70.329999999999998 110.877 -179.893 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 65.4 tt0 -66.34 -39.21 89.05 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.15 -0.477 . . . . 71.329999999999998 110.888 -179.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.489 HG21 ' HB2' ' A' ' 106' ' ' ARG . 89.4 t -62.62 -34.24 64.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.158 -0.474 . . . . 73.310000000000002 111.133 179.982 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -51.97 -45.34 64.4 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.205 -0.452 . . . . 70.040000000000006 110.854 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 17.9 tp10 -56.62 -29.34 62.08 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.21 -0.45 . . . . 74.25 110.893 -179.915 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . 0.474 ' HE1' ' HB2' ' M' ' 15' ' ' LYS . 8.7 mtp -74.46 -56.98 4.24 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.178 -0.464 . . . . 73.319999999999993 110.923 179.971 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 34.7 mm -54.05 -35.57 29.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.23 -0.441 . . . . 75.109999999999999 111.097 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 16.3 tpt180 -65.85 -31.75 72.88 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.203 -0.453 . . . . 73.400000000000006 110.869 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -71.33 -48.82 48.0 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.196 -0.456 . . . . 74.040000000000006 110.903 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.646 ' HB3' HG22 ' A' ' 136' ' ' VAL . . . -71.75 -34.2 69.31 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.165 -0.47 . . . . 63.25 111.089 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 49.8 t0 -68.27 86.79 0.28 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.228 -0.442 . . . . 71.430000000000007 110.887 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 56.5 mt -79.94 -46.0 22.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.204 -0.453 . . . . 71.129999999999995 111.124 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 21.7 p30 -72.7 -8.73 56.8 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.17 -0.468 . . . . 63.509999999999998 110.906 179.822 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 62.84 43.38 99.02 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.725 -0.75 . . . . 63.509999999999998 112.499 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 34.5 p-10 -88.69 -16.01 33.41 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.818 0.342 . . . . 75.340000000000003 110.841 -179.941 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 103.87 2.45 45.96 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.759 -0.734 . . . . 43.520000000000003 112.476 -179.928 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 4.5 tt0 -149.2 172.26 15.13 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.82 0.343 . . . . 74.209999999999994 110.941 -179.913 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 136' ' ' VAL . . . . . 0.646 HG22 ' HB3' ' A' ' 128' ' ' ALA . 94.4 t -108.21 111.82 37.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.204 -0.453 . . . . 72.230000000000004 111.082 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 15.5 p30 -91.85 179.63 5.56 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.155 -0.475 . . . . 74.109999999999999 110.917 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 138' ' ' TYR . . . . . 0.694 ' O ' HG23 ' A' ' 142' ' ' VAL . 36.1 t80 -63.97 -47.65 79.57 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.194 -0.457 . . . . 75.120000000000005 110.927 -179.943 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 14.3 tt0 -52.04 -39.86 60.21 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.139 -0.482 . . . . 62.240000000000002 110.867 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -78.49 -42.46 29.62 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.221 -0.445 . . . . 63.450000000000003 110.898 -179.946 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . 0.556 ' CD2' HD12 ' A' ' 100' ' ' ILE . 24.4 t80 -58.93 -36.7 75.2 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.15 -0.477 . . . . 72.439999999999998 110.859 -179.959 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . 0.753 HG22 HG21 ' A' ' 85' ' ' ILE . 94.0 t -66.66 -44.85 89.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.184 -0.462 . . . . 70.099999999999994 111.119 179.995 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 31.1 tt0 -66.54 -42.94 86.41 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.207 -0.451 . . . . 75.319999999999993 110.91 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 33.6 tpp -65.11 -26.75 68.34 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.216 -0.447 . . . . 73.230000000000004 110.868 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 145' ' ' MET . . . . . 0.407 ' HE1' HG22 ' M' ' 19' ' ' ILE . 0.0 OUTLIER -84.37 -28.16 27.17 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.232 -0.44 . . . . 60.32 110.832 179.973 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 1.6 m . . . . . 0 C--N 1.33 -0.276 0 CA-C-N 116.275 -0.42 . . . . 72.109999999999999 111.092 -179.886 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' M' M ' 15' ' ' LYS . . . . . 0.688 ' HB3' ' HE3' ' A' ' 109' ' ' MET . 11.3 mttm . . . . . 0 N--CA 1.457 -0.08 0 CA-C-O 120.744 0.307 . . . . 75.519999999999996 110.871 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' M' M ' 16' ' ' TRP . . . . . 0.727 ' CE3' HD12 ' M' ' 19' ' ' ILE . 5.6 m95 -52.27 -42.97 64.15 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.231 -0.441 . . . . 75.319999999999993 110.909 179.921 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' M' M ' 17' ' ' GLU . . . . . . . . . . . . . 48.3 tt0 -58.37 -28.08 64.8 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.224 -0.443 . . . . 61.509999999999998 110.902 -179.942 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' M' M ' 18' ' ' LYS . . . . . 0.745 ' HD3' HD13 ' A' ' 112' ' ' LEU . 14.2 ttmm -68.36 -25.85 65.29 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.146 -0.479 . . . . 53.409999999999997 110.892 179.948 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' M' M ' 19' ' ' ILE . . . . . 0.727 HD12 ' CE3' ' M' ' 16' ' ' TRP . 33.5 mt -86.46 -13.2 10.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.23 -0.441 . . . . 64.310000000000002 111.131 179.865 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' M' M ' 20' ' ' ARG . . . . . . . . . . . . . 39.7 ttp180 . . . . . 0 C--N 1.328 -0.335 0 CA-C-N 116.178 -0.465 . . . . 70.219999999999999 110.897 179.926 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' M' M ' 30' ' ' LYS . . . . . . . . . . . . . 17.4 tttm . . . . . 0 C--O 1.232 0.137 0 CA-C-O 120.762 0.315 . . . . 73.540000000000006 110.862 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' M' M ' 31' ' ' LEU . . . . . 0.584 HD23 HG11 ' A' ' 55' ' ' VAL . 10.1 tp -144.94 -52.16 0.28 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.256 -0.429 . . . . 62.420000000000002 110.934 179.941 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' M' M ' 32' ' ' LYS . . . . . . . . . . . . . 3.2 ptmm? -49.53 -36.18 22.63 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.188 -0.46 . . . . 75.519999999999996 110.9 179.824 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' M' M ' 33' ' ' HIS . . . . . . . . . . . . . 12.7 t-160 -49.74 -42.61 46.66 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.201 -0.454 . . . . 73.400000000000006 110.861 179.898 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' M' M ' 34' ' ' ILE . . . . . . . . . . . . . 55.1 mt -50.69 -38.69 17.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.201 -0.454 . . . . 73.409999999999997 111.145 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' M' M ' 35' ' ' VAL . . . . . . . . . . . . . 39.9 t -49.6 -39.54 14.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.139 -0.482 . . . . 75.120000000000005 111.166 179.859 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' M' M ' 36' ' ' TRP . . . . . . . . . . . . . 21.9 m0 -58.94 -39.29 81.18 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.196 -0.456 . . . . 71.239999999999995 110.926 179.966 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' M' M ' 37' ' ' ALA . . . . . 0.98 ' HB3' HD13 ' A' ' 39' ' ' LEU . . . -63.82 -18.64 64.33 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.226 -0.443 . . . . 52.020000000000003 111.091 179.88 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' M' M ' 38' ' ' SER . . . . . 0.533 ' HB3' HD23 ' A' ' 18' ' ' LEU . 0.9 OUTLIER -71.88 -17.96 62.08 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.193 -0.458 . . . . 75.420000000000002 110.843 -179.787 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' M' M ' 39' ' ' ARG . . . . . . . . . . . . . 60.1 mtt180 -56.48 -25.83 52.32 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.201 -0.454 . . . . 74.109999999999999 110.894 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' M' M ' 40' ' ' GLU . . . . . . . . . . . . . 22.7 tt0 -87.43 -47.99 8.33 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.205 -0.452 . . . . 75.200000000000003 110.905 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' M' M ' 41' ' ' LEU . . . . . 0.59 HD21 ' OG ' ' A' ' 38' ' ' SER . 11.7 mt . . . . . 0 C--N 1.328 -0.364 0 CA-C-N 116.179 -0.464 . . . . 73.019999999999996 110.957 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 7.0 tp60 . . . . . 0 C--O 1.232 0.135 0 CA-C-O 120.804 0.335 . . . . 74.030000000000001 110.898 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 78.3 mt -69.35 -40.61 80.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.195 -0.457 . . . . 63.32 111.147 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -53.21 -31.4 42.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.133 -0.485 . . . . 63.539999999999999 111.105 179.787 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -74.12 -39.36 63.4 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.225 -0.443 . . . . 73.120000000000005 110.913 -179.924 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 24.7 m-85 -72.25 -45.89 58.28 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.189 -0.459 . . . . 72.239999999999995 110.918 -179.954 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 24.2 ttpp -67.45 -26.75 66.55 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.148 -0.478 . . . . 71.239999999999995 110.88 179.958 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -67.02 -38.64 86.29 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.256 -0.429 . . . . 75.120000000000005 110.866 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -64.01 -34.06 77.15 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.122 -0.49 . . . . 73.030000000000001 111.121 179.887 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 51.7 t80 -57.3 -53.87 53.18 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.224 -0.444 . . . . 65.200000000000003 110.832 -179.895 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.7 t -52.6 -29.66 27.08 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.175 -0.466 . . . . 54.530000000000001 110.843 -179.785 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 15.6 tp -67.12 -48.17 68.9 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.141 -0.481 . . . . 61.140000000000001 110.91 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 44.5 m-85 -71.78 -25.34 61.98 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.227 -0.442 . . . . 75.319999999999993 110.886 179.922 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 8.1 t0 -82.54 98.56 9.02 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.139 -0.482 . . . . 73.129999999999995 110.903 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.637 ' HE3' HG21 ' A' ' 34' ' ' THR . 21.7 ttmm -69.21 -53.46 19.84 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.206 -0.452 . . . . 61.340000000000003 110.888 179.999 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 9.7 p30 -76.78 -10.09 59.13 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.24 -0.436 . . . . 34.210000000000001 110.833 179.915 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 52.15 46.49 56.47 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.701 -0.761 . . . . 53.539999999999999 112.501 -179.942 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 38.4 p-10 -89.08 -12.47 41.11 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.845 0.355 . . . . 75.219999999999999 110.853 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 105.44 -11.69 47.18 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.72 -0.752 . . . . 64.319999999999993 112.477 -179.965 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 56.0 p -133.59 130.69 38.71 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.788 0.328 . . . . 72.409999999999997 111.125 -179.827 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.529 HD12 ' HB ' ' A' ' 63' ' ' ILE . 47.3 mt -84.45 125.7 40.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.193 -0.458 . . . . 75.439999999999998 111.123 179.908 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.434 HG22 ' CG2' ' A' ' 62' ' ' THR . 28.3 p -107.81 171.09 7.59 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.158 -0.474 . . . . 62.530000000000001 111.109 179.989 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 16.3 p -54.21 -45.02 72.14 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.158 -0.474 . . . . 75.109999999999999 111.187 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 4.9 tmtm? -60.14 -37.3 79.67 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.177 -0.465 . . . . 74.040000000000006 110.911 179.91 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.474 ' O ' HG23 ' A' ' 35' ' ' VAL . 39.4 mt-10 -74.0 -32.86 63.59 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.265 -0.425 . . . . 73.219999999999999 110.89 179.939 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.586 ' O ' HD13 ' A' ' 32' ' ' LEU . 0.9 OUTLIER -74.28 -39.98 62.59 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.169 -0.469 . . . . 73.420000000000002 110.892 -179.967 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -71.58 -38.03 61.78 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.735 -0.745 . . . . 52.509999999999998 112.537 179.87 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.637 HG21 ' HE3' ' A' ' 21' ' ' LYS . 96.1 m -62.79 -55.96 21.75 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.817 0.341 . . . . 72.420000000000002 111.185 -179.899 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.474 HG23 ' O ' ' A' ' 31' ' ' GLU . 71.4 t -54.63 -51.79 47.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.208 -0.451 . . . . 62.310000000000002 111.13 179.875 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 26.4 mtp -52.08 -31.51 30.71 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.205 -0.452 . . . . 71.340000000000003 110.884 179.91 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 45.4 ttp180 -63.37 -43.92 96.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.245 -0.434 . . . . 74.530000000000001 110.865 -179.912 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . 0.619 ' OG ' HD11 ' M' ' 41' ' ' LEU . 1.3 p -65.25 -34.22 77.85 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.163 -0.472 . . . . 51.549999999999997 110.85 -179.779 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.941 HD13 ' HB3' ' M' ' 37' ' ' ALA . 32.1 mt -72.11 -19.84 61.73 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.176 -0.465 . . . . 74.319999999999993 110.892 179.971 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 101.46 30.07 6.05 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.772 -0.728 . . . . 73.200000000000003 112.52 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 83.9 mm-40 -118.64 132.59 56.18 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.798 0.332 . . . . 55.299999999999997 110.928 -179.93 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 33.5 t-20 -109.88 76.63 0.98 Allowed Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.618 0.723 . . . . 64.430000000000007 110.864 -179.9 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . 0.422 ' CG ' HD21 ' A' ' 48' ' ' LEU . 53.6 Cg_endo -69.73 164.65 33.73 Favored 'Trans proline' 0 C--N 1.341 0.17 0 C-N-CA 122.69 2.26 . . . . 73.230000000000004 112.36 179.94 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 19.6 p -112.93 166.41 11.42 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.211 -0.45 . . . . 65.109999999999999 111.172 179.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -59.17 -42.26 90.4 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.229 -0.441 . . . . 75.150000000000006 110.891 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.23 -31.58 64.23 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.153 -0.476 . . . . 44.43 111.079 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -71.88 -52.1 19.01 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.212 -0.449 . . . . 61.350000000000001 110.893 -179.92 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.422 HD21 ' CG ' ' A' ' 43' ' ' PRO . 18.8 mt -56.09 -51.78 66.64 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.16 -0.473 . . . . 74.439999999999998 110.953 179.985 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 28.6 tp60 -52.85 -29.19 26.52 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.174 -0.466 . . . . 62.43 110.935 179.931 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -75.5 -43.4 49.32 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.213 -0.449 . . . . 72.239999999999995 110.892 179.915 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . 0.437 ' HE1' HD13 ' M' ' 31' ' ' LEU . 68.2 mtp -58.31 -58.04 10.26 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.149 -0.478 . . . . 74.040000000000006 110.891 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 79.6 mt -55.89 -42.06 69.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.19 -0.459 . . . . 63.340000000000003 111.115 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 63.4 m-20 -60.51 -31.28 70.34 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.15 -0.477 . . . . 73.209999999999994 110.877 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -71.26 -23.29 61.95 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.196 -0.456 . . . . 75.010000000000005 110.912 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.488 HG11 HD23 ' M' ' 31' ' ' LEU . 2.9 m -114.0 10.87 8.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.15 -0.477 . . . . 34.509999999999998 111.135 179.973 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 23.2 t0 -90.16 97.67 11.32 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.156 -0.475 . . . . 72.340000000000003 110.868 179.943 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.29 -44.27 10.94 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.247 -0.433 . . . . 60.219999999999999 111.106 179.946 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 6.4 p-10 -83.09 -0.22 48.07 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.205 -0.452 . . . . 73.030000000000001 110.865 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 51.6 57.38 12.29 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.712 -0.756 . . . . 62.200000000000003 112.485 -179.952 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 53.1 p-10 -114.56 -15.72 11.97 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.853 0.359 . . . . 55.32 110.845 -179.848 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 89.28 17.81 54.62 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.771 -0.728 . . . . 72.230000000000004 112.459 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . 0.434 ' CG2' HG22 ' A' ' 28' ' ' THR . 28.5 p -150.15 158.67 44.4 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.74 0.305 . . . . 75.530000000000001 111.145 -179.868 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.529 ' HB ' HD12 ' A' ' 27' ' ' ILE . 7.6 mm -94.6 110.12 23.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.267 -0.424 . . . . 71.549999999999997 111.14 179.924 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -77.47 -172.79 2.65 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.151 -0.477 . . . . 75.349999999999994 110.837 179.9 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.537 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 2.5 t80 -64.59 -58.31 13.92 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.621 0.724 . . . . 73.319999999999993 110.852 -179.942 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . 0.537 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 54.2 Cg_endo -69.76 -29.9 23.13 Favored 'Trans proline' 0 N--CA 1.465 -0.159 0 C-N-CA 122.698 2.265 . . . . 63.409999999999997 112.372 -179.981 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 11.5 mt-10 -57.17 -41.63 79.63 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.177 -0.465 . . . . 73.450000000000003 110.865 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 5.7 t80 -72.77 -36.12 67.58 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.166 -0.47 . . . . 72.099999999999994 110.845 -179.898 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 19.2 tp -65.42 -53.76 38.33 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.139 -0.482 . . . . 74.519999999999996 110.91 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 9.4 t -55.24 -28.38 52.83 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.212 -0.449 . . . . 53.200000000000003 111.157 179.944 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 6.2 tmm? -68.12 -40.07 82.58 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.181 -0.463 . . . . 52.219999999999999 110.897 179.911 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . 0.471 ' HE2' HG11 ' M' ' 35' ' ' VAL . 0.0 OUTLIER -79.85 -33.57 40.06 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.194 -0.457 . . . . 65.219999999999999 110.861 179.967 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.296 0 CA-C-N 116.22 -0.446 . . . . 63.310000000000002 111.075 179.936 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.512 HD13 HG13 ' A' ' 142' ' ' VAL . 53.2 mt . . . . . 0 N--CA 1.457 -0.101 0 CA-C-O 120.83 0.347 . . . . 52.420000000000002 111.134 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 12.2 ttt180 -62.21 -28.33 69.61 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.146 -0.479 . . . . 63.399999999999999 110.858 179.977 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.731 ' O ' HG23 ' A' ' 91' ' ' VAL . 11.3 mm-40 -70.21 -58.38 3.84 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.221 -0.445 . . . . 75.409999999999997 110.91 -179.976 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . 0.621 ' HB1' ' CE2' ' A' ' 92' ' ' PHE . . . -54.29 -45.39 72.5 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.095 -0.502 . . . . 42.149999999999999 111.107 179.916 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 6.7 t80 -52.06 -51.33 58.24 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.211 -0.449 . . . . 74.230000000000004 110.909 -179.935 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 13.2 ttt85 -61.68 -40.52 95.26 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.121 -0.49 . . . . 70.099999999999994 110.869 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . 0.731 HG23 ' O ' ' A' ' 87' ' ' GLU . 39.0 t -59.45 -51.15 76.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.214 -0.448 . . . . 75.209999999999994 111.137 179.99 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.621 ' CE2' ' HB1' ' A' ' 88' ' ' ALA . 11.8 m-85 -68.56 -29.04 67.51 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.159 -0.473 . . . . 73.319999999999993 110.838 -179.972 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 33.1 t0 -70.45 94.09 0.94 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.158 -0.473 . . . . 62.009999999999998 110.881 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 2.6 mptm? -78.67 -52.09 8.92 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.215 -0.448 . . . . 75.420000000000002 110.869 -179.962 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 47.6 p30 -72.5 -9.17 58.23 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.219 -0.446 . . . . 64.209999999999994 110.895 179.86 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 59.95 28.71 66.54 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.7 -0.762 . . . . 64.109999999999999 112.521 -179.924 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 45.3 p-10 -82.39 -16.25 49.77 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.882 0.372 . . . . 73.349999999999994 110.896 -179.882 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 88.56 18.66 54.49 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.717 -0.754 . . . . 42.310000000000002 112.452 179.991 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 13.4 m-85 -136.03 159.41 41.78 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.841 0.353 . . . . 72.450000000000003 110.949 -179.827 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.419 HG21 HD13 ' A' ' 105' ' ' LEU . 71.4 mt -122.04 120.84 62.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.119 -0.491 . . . . 74.530000000000001 111.159 179.87 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 4.9 p -114.9 175.0 5.69 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.189 -0.46 . . . . 71.409999999999997 110.864 -179.905 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -66.15 -25.17 66.84 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.119 -0.491 . . . . 55.030000000000001 111.064 179.927 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -71.07 -49.94 39.22 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.228 -0.442 . . . . 75.200000000000003 111.125 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -76.97 -48.05 19.11 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.228 -0.442 . . . . 75.329999999999998 110.899 -179.965 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.525 HD21 ' CE ' ' A' ' 124' ' ' MET . 19.0 tp -53.14 -40.45 64.27 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.155 -0.475 . . . . 73.129999999999995 110.907 -179.957 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 41.6 ttp180 -56.49 -49.43 74.71 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.155 -0.475 . . . . 71.310000000000002 110.894 179.938 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 6.2 t60 -54.28 -36.46 63.68 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.171 -0.468 . . . . 73.230000000000004 110.818 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 85.7 t -63.53 -51.66 67.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.219 -0.446 . . . . 72.129999999999995 111.129 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' MET . . . . . 0.767 ' HE2' HD11 ' M' ' 19' ' ' ILE . 5.4 mmt -60.58 -26.02 66.64 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.239 -0.437 . . . . 75.439999999999998 110.866 179.931 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 1.6 m -66.77 -45.2 79.28 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.206 -0.452 . . . . 43.240000000000002 111.164 -179.956 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 5.6 t30 -55.29 -30.62 60.52 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.245 -0.434 . . . . 63.240000000000002 110.868 179.973 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.742 HD12 ' HA ' ' A' ' 109' ' ' MET . 7.8 mt -75.42 -25.41 57.5 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.227 -0.442 . . . . 71.120000000000005 110.945 179.949 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 101.02 32.98 5.12 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.706 -0.759 . . . . 71.340000000000003 112.487 179.866 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -124.25 109.96 14.04 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.873 0.368 . . . . 74.310000000000002 110.865 -179.8 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 19.2 mmtm -74.76 128.62 36.0 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.143 -0.48 . . . . 61.210000000000001 110.904 179.957 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.481 HD22 ' HG2' ' A' ' 120' ' ' GLU . 10.4 mt -133.17 126.69 32.2 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.235 -0.438 . . . . 75.209999999999994 110.904 179.954 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . 0.624 ' O ' HG23 ' A' ' 121' ' ' VAL . 68.6 p -79.3 -175.06 4.48 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.212 -0.449 . . . . 55.009999999999998 111.109 179.952 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -59.84 -40.26 87.92 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.18 -0.464 . . . . 71.510000000000005 110.865 179.935 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -75.71 -33.39 60.32 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.253 -0.431 . . . . 73.420000000000002 110.86 -179.912 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . 0.481 ' HG2' HD22 ' A' ' 116' ' ' LEU . 46.8 tt0 -71.98 -38.17 69.74 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.163 -0.471 . . . . 63.219999999999999 110.894 -179.931 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.624 HG23 ' O ' ' A' ' 117' ' ' THR . 92.8 t -74.31 -30.55 26.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.181 -0.463 . . . . 75.239999999999995 111.109 179.973 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -78.54 -28.29 46.07 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.2 -0.455 . . . . 73.530000000000001 110.839 179.961 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 23.0 tp10 -55.52 -49.99 71.16 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.224 -0.444 . . . . 72.400000000000006 110.904 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . 0.525 ' CE ' HD21 ' A' ' 105' ' ' LEU . 13.6 ptm -66.42 -44.12 83.83 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.156 -0.474 . . . . 50.420000000000002 110.922 179.953 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 29.3 mm -53.87 -35.38 27.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.175 -0.466 . . . . 75.340000000000003 111.138 179.945 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 14.1 ttt85 -67.18 -31.7 72.28 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.187 -0.46 . . . . 75.209999999999994 110.867 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 13.1 tp10 -69.14 -45.16 70.8 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.18 -0.464 . . . . 72.329999999999998 110.923 -179.975 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.602 ' HB3' HG22 ' A' ' 136' ' ' VAL . . . -77.12 -33.18 56.88 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.154 -0.476 . . . . 63.299999999999997 111.091 179.918 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 47.6 t0 -68.9 85.99 0.34 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.258 -0.428 . . . . 72.230000000000004 110.836 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 57.0 mt -79.69 -45.55 23.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.218 -0.446 . . . . 72.040000000000006 111.135 179.977 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 24.5 p30 -72.87 -8.63 56.46 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.175 -0.466 . . . . 61.340000000000003 110.854 179.849 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 62.72 41.91 99.77 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.793 -0.718 . . . . 52.509999999999998 112.463 -179.952 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 13.3 p-10 -87.6 -15.84 36.21 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.843 0.354 . . . . 75.230000000000004 110.851 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 102.41 4.23 49.99 Favored Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.687 -0.768 . . . . 62.32 112.482 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -149.19 172.18 15.26 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.861 0.362 . . . . 71.420000000000002 110.909 -179.873 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 136' ' ' VAL . . . . . 0.602 HG22 ' HB3' ' A' ' 128' ' ' ALA . 99.6 t -110.83 113.75 45.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.185 -0.461 . . . . 63.539999999999999 111.128 179.976 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 14.0 p30 -91.02 167.87 12.07 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.132 -0.486 . . . . 72.420000000000002 110.885 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 138' ' ' TYR . . . . . 0.594 ' O ' HG23 ' A' ' 142' ' ' VAL . 88.7 t80 -52.08 -47.17 65.32 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.171 -0.468 . . . . 64.549999999999997 110.92 -179.909 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 26.1 tp10 -52.53 -51.78 57.95 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.104 -0.498 . . . . 64.200000000000003 110.844 -179.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 51.7 mt-10 -66.16 -39.88 90.11 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.179 -0.464 . . . . 54.109999999999999 110.899 -179.919 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 75.7 t80 -59.45 -49.16 78.86 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.181 -0.463 . . . . 74.120000000000005 110.879 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . 0.594 HG23 ' O ' ' A' ' 138' ' ' TYR . 91.8 t -56.58 -40.08 66.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.164 -0.471 . . . . 75.430000000000007 111.162 179.94 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 6.9 tp-100 -70.01 -28.34 65.42 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.179 -0.464 . . . . 75.25 110.895 179.998 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 9.5 tpt -74.6 -54.03 8.24 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.229 -0.441 . . . . 61.5 110.89 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 145' ' ' MET . . . . . 0.484 ' HE2' ' HA ' ' M' ' 20' ' ' ARG . 7.7 ttm -66.88 -27.17 67.29 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.218 -0.446 . . . . 71.019999999999996 110.875 179.942 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 2.3 m . . . . . 0 C--N 1.329 -0.288 0 CA-C-N 116.233 -0.439 . . . . 54.229999999999997 111.139 -179.888 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' M' M ' 15' ' ' LYS . . . . . . . . . . . . . 24.1 mttp . . . . . 0 C--O 1.231 0.103 0 CA-C-O 120.736 0.303 . . . . 74.129999999999995 110.852 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' M' M ' 16' ' ' TRP . . . . . 0.707 ' CE3' HD12 ' M' ' 19' ' ' ILE . 46.2 m95 -52.77 -40.55 63.26 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.217 -0.447 . . . . 74.109999999999999 110.904 179.972 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' M' M ' 17' ' ' GLU . . . . . . . . . . . . . 28.5 tt0 -55.43 -26.28 41.0 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.234 -0.439 . . . . 55.509999999999998 110.87 -179.948 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' M' M ' 18' ' ' LYS . . . . . . . . . . . . . 16.2 ttpp -77.65 -28.02 51.16 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.145 -0.48 . . . . 73.319999999999993 110.841 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' M' M ' 19' ' ' ILE . . . . . 0.767 HD11 ' HE2' ' A' ' 109' ' ' MET . 60.2 mt -78.3 -29.38 15.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.22 -0.446 . . . . 63.32 111.164 179.894 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' M' M ' 20' ' ' ARG . . . . . 0.484 ' HA ' ' HE2' ' A' ' 145' ' ' MET . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.288 0 CA-C-N 116.157 -0.474 . . . . 63.130000000000003 110.906 179.906 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' M' M ' 30' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.232 0.143 0 CA-C-O 120.825 0.345 . . . . 74.219999999999999 110.905 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' M' M ' 31' ' ' LEU . . . . . 0.488 HD23 HG11 ' A' ' 55' ' ' VAL . 25.9 tp -141.72 -55.44 0.46 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.258 -0.428 . . . . 72.439999999999998 110.897 179.938 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' M' M ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.68 -45.38 48.71 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.183 -0.462 . . . . 55.119999999999997 110.909 179.851 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' M' M ' 33' ' ' HIS . . . . . . . . . . . . . 19.0 t-80 -50.36 -36.91 34.42 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.166 -0.47 . . . . 62.130000000000003 110.864 179.897 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' M' M ' 34' ' ' ILE . . . . . . . . . . . . . 49.7 mm -49.74 -40.83 16.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.191 -0.459 . . . . 51.140000000000001 111.171 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' M' M ' 35' ' ' VAL . . . . . 0.471 HG11 ' HE2' ' A' ' 72' ' ' MET . 65.9 t -49.26 -40.63 13.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.15 -0.477 . . . . 65.030000000000001 111.176 179.772 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' M' M ' 36' ' ' TRP . . . . . . . . . . . . . 28.8 m0 -59.31 -38.88 81.35 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.14 -0.482 . . . . 65.420000000000002 110.965 179.962 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' M' M ' 37' ' ' ALA . . . . . 0.941 ' HB3' HD13 ' A' ' 39' ' ' LEU . . . -63.9 -18.61 64.37 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.167 -0.47 . . . . 73.0 111.108 179.876 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' M' M ' 38' ' ' SER . . . . . . . . . . . . . 2.5 m -70.61 -17.97 62.89 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.234 -0.439 . . . . 53.420000000000002 110.86 -179.82 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' M' M ' 39' ' ' ARG . . . . . . . . . . . . . 16.2 mmm180 -60.13 -26.8 66.54 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.176 -0.466 . . . . 75.129999999999995 110.878 -179.932 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' M' M ' 40' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -74.63 -47.76 30.28 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.205 -0.452 . . . . 64.150000000000006 110.908 -179.946 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' M' M ' 41' ' ' LEU . . . . . 0.619 HD11 ' OG ' ' A' ' 38' ' ' SER . 15.3 mt . . . . . 0 C--N 1.328 -0.345 0 CA-C-N 116.17 -0.468 . . . . 62.43 110.92 -179.991 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 7.5 tp60 . . . . . 0 C--O 1.231 0.086 0 CA-C-O 120.732 0.301 . . . . 61.439999999999998 110.893 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 41.4 mt -68.58 -37.09 77.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.209 -0.451 . . . . 74.140000000000001 111.12 179.975 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -52.0 -33.16 37.03 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.15 -0.477 . . . . 75.319999999999993 111.139 179.815 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 16.2 mm-40 -74.9 -51.87 12.73 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.203 -0.453 . . . . 65.439999999999998 110.878 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.562 ' CB ' HD13 ' A' ' 69' ' ' LEU . 64.5 m-85 -58.18 -46.03 86.47 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.191 -0.459 . . . . 73.519999999999996 110.888 -179.925 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 19.5 ttmm -54.18 -30.45 49.58 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.159 -0.473 . . . . 75.129999999999995 110.886 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -70.84 -30.69 67.18 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.223 -0.444 . . . . 65.209999999999994 110.87 179.946 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -67.02 -48.16 69.22 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.16 -0.473 . . . . 65.200000000000003 111.083 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 79.2 t80 -56.09 -54.28 46.97 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.2 -0.454 . . . . 63.210000000000001 110.891 -179.932 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 20.6 t -58.99 -26.49 64.54 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.174 -0.466 . . . . 53.340000000000003 110.88 -179.8 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 1.2 tt -68.75 -37.33 79.31 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.117 -0.492 . . . . 73.140000000000001 110.909 -179.999 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.625 ' CD1' HG11 ' A' ' 35' ' ' VAL . 22.3 m-85 -81.33 -39.09 25.65 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.19 -0.459 . . . . 75.430000000000007 110.88 179.943 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 26.5 t0 -62.97 98.56 0.13 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.164 -0.471 . . . . 73.549999999999997 110.906 179.931 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.14 -56.05 6.24 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.223 -0.444 . . . . 75.129999999999995 110.919 179.978 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 2.3 p-10 -70.86 -10.45 59.62 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.212 -0.449 . . . . 70.230000000000004 110.859 179.901 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 50.86 66.43 2.47 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.708 -0.758 . . . . 74.019999999999996 112.496 -179.93 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 35.3 p-10 -114.47 -15.71 12.02 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.828 0.347 . . . . 51.420000000000002 110.848 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 100.53 10.28 44.62 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.755 -0.736 . . . . 75.230000000000004 112.457 -179.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 51.0 p -151.29 130.7 12.91 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.771 0.319 . . . . 61.399999999999999 111.135 -179.865 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.48 HD12 ' HB ' ' A' ' 63' ' ' ILE . 22.5 mt -91.08 121.78 41.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.218 -0.446 . . . . 74.010000000000005 111.071 179.952 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.411 ' HA ' HG22 ' A' ' 62' ' ' THR . 30.0 p -107.77 172.82 6.62 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.153 -0.476 . . . . 54.200000000000003 111.128 179.932 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.4 HG22 HD12 ' A' ' 52' ' ' ILE . 71.4 p -61.41 -27.55 68.61 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.201 -0.454 . . . . 71.299999999999997 111.164 -179.991 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 19.5 mmmt -75.7 -35.19 60.36 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.223 -0.444 . . . . 64.349999999999994 110.93 179.909 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 -76.06 -32.66 59.4 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.19 -0.459 . . . . 74.319999999999993 110.898 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.651 HD12 ' CD2' ' A' ' 48' ' ' LEU . 1.2 tm? -67.15 -39.79 86.6 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.123 -0.49 . . . . 65.200000000000003 110.93 -179.965 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -67.92 -35.51 84.68 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.71 -0.757 . . . . 72.450000000000003 112.528 179.849 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 74.6 m -62.81 -55.47 26.11 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.808 0.337 . . . . 54.409999999999997 111.158 -179.876 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.625 HG11 ' CD1' ' A' ' 19' ' ' PHE . 92.4 t -65.28 -53.32 41.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.248 -0.433 . . . . 75.349999999999994 111.109 179.901 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -51.9 -31.5 28.66 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.179 -0.464 . . . . 72.450000000000003 110.884 179.947 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 48.6 ttt180 -65.95 -47.09 75.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.221 -0.445 . . . . 71.200000000000003 110.897 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . 0.629 ' OG ' HD11 ' M' ' 41' ' ' LEU . 1.3 p -63.66 -33.67 76.15 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.159 -0.473 . . . . 65.040000000000006 110.888 -179.81 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.948 HD13 ' HB3' ' M' ' 37' ' ' ALA . 57.7 mt -68.09 -22.11 64.93 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.1 -0.5 . . . . 73.019999999999996 110.91 -179.979 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 101.43 31.37 5.56 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.729 -0.748 . . . . 74.340000000000003 112.505 179.915 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 13.9 mt-30 -128.29 118.62 23.57 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.793 0.33 . . . . 64.010000000000005 110.911 -179.896 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 1.2 t30 -109.86 76.92 1.0 Allowed Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.65 0.738 . . . . 61.149999999999999 110.86 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . 0.521 ' HG2' HD21 ' A' ' 48' ' ' LEU . 53.3 Cg_endo -69.85 168.08 22.71 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.695 2.263 . . . . 65.439999999999998 112.297 179.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 30.9 p -90.78 161.69 15.18 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.234 -0.439 . . . . 71.319999999999993 111.081 -179.91 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 25.2 tt0 -51.95 -43.7 63.62 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.157 -0.474 . . . . 72.329999999999998 110.883 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.14 -31.49 64.3 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.142 -0.481 . . . . 61.25 111.063 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 53.7 tt0 -65.96 -48.25 71.93 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.238 -0.437 . . . . 60.039999999999999 110.917 -179.938 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.651 ' CD2' HD12 ' A' ' 32' ' ' LEU . 46.4 mt -55.34 -35.35 65.09 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.152 -0.476 . . . . 71.299999999999997 110.932 -179.984 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 43.8 tp60 -70.92 -28.96 64.9 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.184 -0.462 . . . . 72.129999999999995 110.873 179.945 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 29.3 t0 -68.73 -46.61 68.47 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.216 -0.447 . . . . 65.150000000000006 110.869 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . 0.601 ' SD ' HD11 ' M' ' 34' ' ' ILE . 10.7 mtp -60.18 -53.0 62.9 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.184 -0.462 . . . . 72.310000000000002 110.877 179.992 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.667 HG23 HD11 ' A' ' 63' ' ' ILE . 73.3 mt -60.46 -41.25 86.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.226 -0.443 . . . . 51.219999999999999 111.159 179.962 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 70.7 m-20 -67.89 -32.73 73.42 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.155 -0.475 . . . . 74.329999999999998 110.894 179.934 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 18.4 mm-40 -61.01 -23.28 65.29 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.182 -0.463 . . . . 54.420000000000002 110.887 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.49 ' CG2' HD12 ' A' ' 63' ' ' ILE . 3.8 m -112.52 -14.89 10.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.162 -0.472 . . . . 40.009999999999998 111.109 179.96 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 33.0 t0 -66.79 97.07 0.44 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.172 -0.467 . . . . 71.510000000000005 110.85 179.936 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.46 -32.71 18.12 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.159 -0.473 . . . . 72.099999999999994 111.074 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -91.69 -0.43 57.56 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.234 -0.439 . . . . 72.25 110.851 179.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 51.46 62.21 5.68 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.699 -0.762 . . . . 41.149999999999999 112.509 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 50.7 p-10 -114.58 -15.75 11.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.864 0.364 . . . . 60.240000000000002 110.877 -179.873 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 89.11 15.83 58.54 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.751 -0.738 . . . . 63.100000000000001 112.49 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . 0.411 HG22 ' HA ' ' A' ' 28' ' ' THR . 30.7 p -152.17 161.54 42.47 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.758 0.313 . . . . 74.540000000000006 111.143 -179.865 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.667 HD11 HG23 ' A' ' 52' ' ' ILE . 8.6 mm -99.26 114.8 38.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.194 -0.457 . . . . 72.519999999999996 111.133 179.921 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -81.79 -173.01 4.2 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.153 -0.476 . . . . 63.329999999999998 110.88 179.846 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.535 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 2.5 t80 -66.55 -58.3 10.38 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.669 0.747 . . . . 74.409999999999997 110.857 -179.911 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . 0.535 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 53.1 Cg_endo -69.78 -29.41 23.8 Favored 'Trans proline' 0 C--N 1.342 0.202 0 C-N-CA 122.677 2.251 . . . . 73.450000000000003 112.332 -179.947 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -61.48 -40.26 93.91 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.217 -0.447 . . . . 72.040000000000006 110.896 -179.976 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 14.7 t80 -74.52 -35.56 63.16 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.149 -0.478 . . . . 53.200000000000003 110.886 -179.955 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.562 HD13 ' CB ' ' A' ' 12' ' ' PHE . 19.0 tp -69.98 -54.16 14.49 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.121 -0.49 . . . . 72.209999999999994 110.921 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 14.8 t -51.93 -29.77 21.68 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.146 -0.479 . . . . 75.310000000000002 111.109 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 3.6 tmm? -61.86 -43.4 98.92 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.247 -0.433 . . . . 74.150000000000006 110.844 179.937 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . 0.586 ' HE3' HG11 ' M' ' 35' ' ' VAL . 3.8 mmt -79.85 -29.4 40.06 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.249 -0.432 . . . . 71.310000000000002 110.846 179.999 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.273 0 CA-C-N 116.233 -0.44 . . . . 75.140000000000001 111.146 179.909 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.608 HD13 HG13 ' A' ' 142' ' ' VAL . 47.7 mt . . . . . 0 C--O 1.232 0.141 0 CA-C-O 120.804 0.335 . . . . 74.5 111.147 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 2.7 ttt180 -61.13 -32.42 72.12 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.167 -0.469 . . . . 71.140000000000001 110.865 179.942 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.715 ' O ' HG23 ' A' ' 91' ' ' VAL . 35.2 mt-10 -76.68 -57.18 4.0 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.224 -0.444 . . . . 62.409999999999997 110.9 -179.924 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . 0.437 ' HB1' ' CE2' ' A' ' 92' ' ' PHE . . . -53.49 -51.03 64.08 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.177 -0.465 . . . . 55.109999999999999 111.081 179.924 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -54.2 -41.79 69.0 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.191 -0.458 . . . . 54.109999999999999 110.878 -179.932 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 73.1 ttt180 -70.41 -27.32 64.19 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.161 -0.472 . . . . 62.5 110.9 -179.942 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . 0.715 HG23 ' O ' ' A' ' 87' ' ' GLU . 93.7 t -75.61 -28.26 19.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.178 -0.464 . . . . 62.299999999999997 111.141 -179.996 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.467 ' CE1' HG11 ' A' ' 108' ' ' VAL . 8.8 m-85 -93.08 -35.64 13.11 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.144 -0.48 . . . . 75.219999999999999 110.898 -179.974 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 35.1 t0 -64.67 94.16 0.12 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.125 -0.489 . . . . 61.520000000000003 110.857 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 10.1 tppt? -78.64 -51.52 9.76 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.193 -0.458 . . . . 74.349999999999994 110.915 179.961 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 17.8 p30 -72.7 -9.14 58.28 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.218 -0.446 . . . . 74.299999999999997 110.834 179.919 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 59.76 28.32 65.45 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.713 -0.756 . . . . 62.310000000000002 112.528 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 43.8 p-10 -81.85 -16.18 51.64 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.887 0.375 . . . . 70.109999999999999 110.893 -179.87 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 91.03 18.64 46.05 Favored Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.717 -0.754 . . . . 73.540000000000006 112.5 179.963 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 12.5 m-85 -136.6 148.18 47.36 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.907 0.384 . . . . 71.230000000000004 110.933 -179.812 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 78.8 mt -113.78 121.33 65.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.139 -0.482 . . . . 64.219999999999999 111.114 179.921 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 17.8 p -116.2 175.25 5.63 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.145 -0.479 . . . . 74.510000000000005 110.859 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . 0.405 ' HB1' HG12 ' A' ' 121' ' ' VAL . . . -66.33 -33.32 75.48 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.129 -0.487 . . . . 74.340000000000003 111.079 179.933 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -61.59 -49.93 74.64 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.251 -0.431 . . . . 73.420000000000002 111.076 179.987 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 23.7 mt-10 -76.91 -49.18 16.21 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.207 -0.452 . . . . 74.430000000000007 110.925 -179.962 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.535 HD21 ' CE ' ' A' ' 124' ' ' MET . 18.9 tp -53.3 -34.49 57.55 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.114 -0.494 . . . . 54.409999999999997 110.931 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 57.4 ttp180 -59.8 -48.05 83.23 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.2 -0.455 . . . . 75.25 110.843 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 70.9 t60 -54.38 -34.39 61.12 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.203 -0.453 . . . . 61.420000000000002 110.831 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.467 HG11 ' CE1' ' A' ' 92' ' ' PHE . 42.3 t -65.5 -48.9 81.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.243 -0.435 . . . . 72.430000000000007 111.139 -179.994 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 7.6 mmt -59.48 -45.06 92.75 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.163 -0.471 . . . . 54.140000000000001 110.866 179.922 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -57.56 -39.11 75.96 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.183 -0.462 . . . . 72.140000000000001 111.183 -179.942 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 10.6 t-20 -74.59 -26.55 59.99 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.168 -0.469 . . . . 72.219999999999999 110.9 179.966 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 12.3 mt -70.77 -25.97 63.14 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.238 -0.437 . . . . 63.420000000000002 110.903 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 101.01 33.02 5.11 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.724 -0.75 . . . . 74.140000000000001 112.452 179.862 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -124.05 113.43 18.38 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.948 0.404 . . . . 70.530000000000001 110.865 -179.863 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . 0.672 ' O ' HD23 ' A' ' 116' ' ' LEU . 9.1 pttm -70.32 118.68 13.44 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.131 -0.486 . . . . 74.420000000000002 110.913 179.967 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.672 HD23 ' O ' ' A' ' 115' ' ' LYS . 24.5 mt -137.41 163.3 31.39 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.2 -0.455 . . . . 71.230000000000004 110.89 179.97 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . 0.453 ' O ' HG23 ' A' ' 121' ' ' VAL . 65.9 p -113.01 174.45 5.89 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.22 -0.445 . . . . 74.109999999999999 111.132 179.925 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -53.37 -48.11 68.88 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.223 -0.444 . . . . 64.109999999999999 110.875 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 49.9 tt0 -62.47 -38.57 90.35 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.23 -0.441 . . . . 72.120000000000005 110.886 -179.92 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . 0.655 ' HG2' HD22 ' A' ' 116' ' ' LEU . 7.4 tp10 -61.55 -46.77 88.52 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.143 -0.48 . . . . 72.519999999999996 110.897 -179.95 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.453 HG23 ' O ' ' A' ' 117' ' ' THR . 62.1 t -57.07 -32.22 39.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.18 -0.464 . . . . 71.319999999999993 111.127 179.974 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 3.1 t70 -78.51 -28.49 46.29 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.192 -0.458 . . . . 61.329999999999998 110.88 179.919 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 34.5 tp10 -55.6 -50.0 71.28 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.203 -0.453 . . . . 73.319999999999993 110.88 -179.928 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . 0.535 ' CE ' HD21 ' A' ' 105' ' ' LEU . 13.4 ptm -66.61 -44.36 82.29 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.16 -0.473 . . . . 53.350000000000001 110.878 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 28.9 mm -53.88 -35.47 27.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.189 -0.46 . . . . 65.120000000000005 111.099 179.959 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 18.3 ttt-85 -66.88 -31.58 72.28 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.197 -0.456 . . . . 73.439999999999998 110.868 179.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 6.9 tm-20 -70.36 -47.26 61.79 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.164 -0.471 . . . . 75.150000000000006 110.83 -179.896 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.47 ' HB3' HG22 ' A' ' 136' ' ' VAL . . . -74.23 -33.8 63.47 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.184 -0.462 . . . . 65.319999999999993 111.068 179.957 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 50.1 t0 -68.54 86.74 0.31 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.257 -0.429 . . . . 62.329999999999998 110.867 -179.999 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 57.7 mt -79.75 -45.61 23.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.182 -0.463 . . . . 73.140000000000001 111.116 -179.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 22.9 p30 -72.73 -8.69 56.62 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.201 -0.454 . . . . 73.329999999999998 110.851 179.864 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 62.31 41.57 99.74 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.769 -0.729 . . . . 62.039999999999999 112.517 -179.925 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 34.6 p-10 -86.85 -15.91 37.71 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.851 0.358 . . . . 73.239999999999995 110.848 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 101.93 3.72 51.78 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.76 -0.733 . . . . 62.43 112.47 -179.94 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 3.5 tt0 -149.23 172.22 15.21 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.83 0.348 . . . . 53.329999999999998 110.895 -179.892 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 136' ' ' VAL . . . . . 0.47 HG22 ' HB3' ' A' ' 128' ' ' ALA . 95.0 t -111.66 108.56 25.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.214 -0.448 . . . . 73.340000000000003 111.134 180.0 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 17.5 p30 -86.24 175.62 8.38 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.163 -0.471 . . . . 62.530000000000001 110.877 -179.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 138' ' ' TYR . . . . . 0.604 ' O ' HG23 ' A' ' 142' ' ' VAL . 39.6 t80 -60.94 -46.52 90.38 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.193 -0.458 . . . . 54.32 110.968 -179.963 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 79.4 tt0 -52.62 -36.45 56.48 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.054 -0.521 . . . . 74.25 110.878 -179.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -78.41 -40.62 35.39 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.145 -0.479 . . . . 75.329999999999998 110.872 -179.911 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . 0.577 ' HD1' HG23 ' A' ' 85' ' ' ILE . 26.7 t80 -62.31 -46.92 86.56 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.177 -0.465 . . . . 74.219999999999999 110.88 -179.891 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . 0.608 HG13 HD13 ' A' ' 85' ' ' ILE . 83.1 t -51.61 -46.93 38.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.186 -0.461 . . . . 73.319999999999993 111.164 179.917 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 3.8 tt0 -71.9 -24.96 61.74 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.175 -0.466 . . . . 70.319999999999993 110.939 179.998 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 7.0 tpt -74.04 -42.36 60.38 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.192 -0.458 . . . . 71.129999999999995 110.883 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -71.77 -27.7 63.14 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.238 -0.437 . . . . 72.230000000000004 110.901 179.926 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 1.8 m . . . . . 0 C--N 1.33 -0.272 0 CA-C-N 116.239 -0.437 . . . . 72.219999999999999 111.098 -179.885 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' M' M ' 15' ' ' LYS . . . . . . . . . . . . . 7.3 mtmp? . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.753 0.311 . . . . 70.140000000000001 110.917 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' M' M ' 16' ' ' TRP . . . . . 0.721 ' CE3' HD12 ' M' ' 19' ' ' ILE . 18.0 m95 -54.6 -41.14 69.57 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.149 -0.478 . . . . 73.299999999999997 110.953 179.917 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' M' M ' 17' ' ' GLU . . . . . . . . . . . . . 15.8 tt0 -57.87 -26.57 62.28 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.215 -0.448 . . . . 71.420000000000002 110.862 -179.974 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' M' M ' 18' ' ' LYS . . . . . . . . . . . . . 19.8 tttp -73.5 -25.75 60.58 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.165 -0.471 . . . . 54.009999999999998 110.916 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' M' M ' 19' ' ' ILE . . . . . 0.721 HD12 ' CE3' ' M' ' 16' ' ' TRP . 31.5 mt -82.63 -20.96 9.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.194 -0.457 . . . . 73.219999999999999 111.103 179.882 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' M' M ' 20' ' ' ARG . . . . . . . . . . . . . 36.6 ttm180 . . . . . 0 C--N 1.329 -0.324 0 CA-C-N 116.199 -0.455 . . . . 71.439999999999998 110.921 179.918 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' M' M ' 30' ' ' LYS . . . . . . . . . . . . . 11.4 tttm . . . . . 0 C--O 1.233 0.186 0 CA-C-O 120.791 0.329 . . . . 62.43 110.896 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' M' M ' 31' ' ' LEU . . . . . 0.569 HD12 HD12 ' M' ' 34' ' ' ILE . 10.0 tp 179.72 -47.87 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.265 -0.425 . . . . 60.119999999999997 110.925 179.917 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' M' M ' 32' ' ' LYS . . . . . . . . . . . . . 1.3 ttmm -48.26 -45.8 34.9 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.179 -0.464 . . . . 74.340000000000003 110.879 179.816 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' M' M ' 33' ' ' HIS . . . . . . . . . . . . . 35.1 t60 -49.99 -39.82 42.31 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.211 -0.449 . . . . 73.430000000000007 110.877 179.928 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' M' M ' 34' ' ' ILE . . . . . 0.601 HD11 ' SD ' ' A' ' 51' ' ' MET . 58.9 mt -50.08 -40.21 16.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.197 -0.456 . . . . 71.109999999999999 111.091 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' M' M ' 35' ' ' VAL . . . . . 0.586 HG11 ' HE3' ' A' ' 72' ' ' MET . 62.5 t -48.36 -41.29 10.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.227 -0.442 . . . . 74.420000000000002 111.101 179.864 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' M' M ' 36' ' ' TRP . . . . . . . . . . . . . 22.0 m0 -58.43 -40.47 82.6 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.217 -0.447 . . . . 73.120000000000005 110.914 179.988 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' M' M ' 37' ' ' ALA . . . . . 0.948 ' HB3' HD13 ' A' ' 39' ' ' LEU . . . -64.09 -18.85 64.79 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.201 -0.454 . . . . 45.549999999999997 111.106 179.888 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' M' M ' 38' ' ' SER . . . . . . . . . . . . . 1.1 m -69.31 -17.94 63.77 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.223 -0.444 . . . . 72.200000000000003 110.84 -179.764 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' M' M ' 39' ' ' ARG . . . . . . . . . . . . . 45.0 mtp180 -71.51 -21.76 61.88 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.163 -0.471 . . . . 41.420000000000002 110.869 -179.93 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' M' M ' 40' ' ' GLU . . . . . . . . . . . . . 22.2 mm-40 -73.94 -48.0 33.71 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.206 -0.452 . . . . 54.420000000000002 110.924 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' M' M ' 41' ' ' LEU . . . . . 0.629 HD11 ' OG ' ' A' ' 38' ' ' SER . 13.6 mt . . . . . 0 C--N 1.328 -0.341 0 CA-C-N 116.174 -0.466 . . . . 73.040000000000006 110.939 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 1.2 tp-100 . . . . . 0 C--O 1.232 0.147 0 CA-C-O 120.777 0.322 . . . . 72.230000000000004 110.899 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . 0.668 HG23 HD22 ' A' ' 69' ' ' LEU . 54.6 mt -69.68 -40.12 78.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.252 -0.431 . . . . 42.310000000000002 111.156 179.931 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.63 -26.05 66.74 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.135 -0.484 . . . . 71.310000000000002 111.085 179.847 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 15.4 mm-40 -74.15 -51.93 14.07 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.261 -0.427 . . . . 73.230000000000004 110.867 -179.92 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 16.6 m-85 -69.03 -38.06 78.97 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.213 -0.449 . . . . 65.129999999999995 110.902 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 19.7 ttmt -52.09 -50.38 61.73 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.141 -0.481 . . . . 71.019999999999996 110.928 179.932 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -56.54 -37.25 70.24 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.171 -0.468 . . . . 63.329999999999998 110.885 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -59.6 -25.56 64.72 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.169 -0.469 . . . . 54.420000000000002 111.071 179.952 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 73.8 t80 -70.94 -54.03 12.84 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.215 -0.448 . . . . 64.340000000000003 110.842 -179.895 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 74.9 m -52.79 -31.37 38.23 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.131 -0.486 . . . . 73.329999999999998 110.892 -179.768 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.427 HD23 ' HB3' ' M' ' 38' ' ' SER . 16.3 tp -63.07 -39.93 96.18 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.101 -0.499 . . . . 74.420000000000002 110.902 -179.996 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.645 ' CD1' HG11 ' A' ' 35' ' ' VAL . 33.7 m-85 -79.61 -35.88 38.86 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.213 -0.449 . . . . 71.439999999999998 110.899 179.916 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 16.1 t0 -67.56 98.51 0.68 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.165 -0.47 . . . . 64.040000000000006 110.919 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 3.2 tppt? -70.28 -54.31 13.22 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.209 -0.45 . . . . 72.430000000000007 110.911 -179.96 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 19.3 p-10 -75.73 -10.04 59.1 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.221 -0.445 . . . . 52.409999999999997 110.88 179.848 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 52.18 46.09 56.95 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.732 -0.747 . . . . 60.549999999999997 112.482 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 25.0 p-10 -93.59 -15.75 25.08 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.854 0.359 . . . . 64.510000000000005 110.891 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 100.32 18.04 22.75 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.789 -0.719 . . . . 42.200000000000003 112.479 -179.942 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -154.62 130.82 10.35 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.776 0.322 . . . . 73.510000000000005 111.142 -179.858 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.488 HG22 ' HB2' ' A' ' 32' ' ' LEU . 25.6 mt -94.25 119.84 42.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.205 -0.452 . . . . 74.400000000000006 111.182 179.896 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.661 HG22 ' CG2' ' A' ' 62' ' ' THR . 20.2 p -107.61 176.24 5.22 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.182 -0.463 . . . . 74.239999999999995 111.166 -179.986 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.424 HG23 ' CD1' ' A' ' 52' ' ' ILE . 1.5 p -66.8 -33.95 76.74 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.26 -0.427 . . . . 72.420000000000002 111.14 -179.962 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 45.3 mtmt -61.44 -50.13 74.02 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.237 -0.438 . . . . 74.349999999999994 110.879 179.923 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.553 ' O ' HG23 ' A' ' 35' ' ' VAL . 8.2 mt-10 -76.06 -52.88 9.24 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.244 -0.435 . . . . 72.439999999999998 110.893 179.955 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.488 ' HB2' HG22 ' A' ' 27' ' ' ILE . 3.0 tm? -53.34 -40.67 65.07 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.169 -0.468 . . . . 73.420000000000002 110.922 -179.979 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -70.15 -30.66 69.5 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.785 -0.721 . . . . 45.009999999999998 112.491 179.893 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 96.6 m -74.48 -46.13 41.58 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.771 0.32 . . . . 74.310000000000002 111.12 -179.862 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.645 HG11 ' CD1' ' A' ' 19' ' ' PHE . 47.4 t -51.54 -47.37 36.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.233 -0.44 . . . . 51.420000000000002 111.144 179.892 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . 0.602 ' SD ' HD13 ' M' ' 34' ' ' ILE . 0.0 OUTLIER -56.22 -34.8 66.64 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.2 -0.454 . . . . 73.219999999999999 110.869 179.89 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 42.1 ttt-85 -56.41 -40.36 74.56 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.229 -0.442 . . . . 62.450000000000003 110.911 -179.912 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . 0.681 ' OG ' HD21 ' M' ' 41' ' ' LEU . 5.2 t -76.54 -26.26 54.97 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.181 -0.463 . . . . 72.430000000000007 110.839 -179.807 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 1.011 HD13 ' HB3' ' M' ' 37' ' ' ALA . 60.9 mt -81.48 -21.92 38.4 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.116 -0.493 . . . . 71.099999999999994 110.933 -179.99 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 101.45 31.32 5.57 Favored Glycine 0 N--CA 1.452 -0.251 0 C-N-CA 120.722 -0.751 . . . . 45.140000000000001 112.477 179.856 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 5.7 mm100 -122.62 124.82 44.35 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.796 0.331 . . . . 75.010000000000005 110.923 -179.895 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 1.1 t30 -109.87 76.58 0.97 Allowed Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.603 0.716 . . . . 74.430000000000007 110.911 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . 0.442 ' CG ' HD21 ' A' ' 48' ' ' LEU . 54.2 Cg_endo -69.71 167.97 22.82 Favored 'Trans proline' 0 C--O 1.232 0.177 0 C-N-CA 122.675 2.25 . . . . 72.019999999999996 112.397 179.908 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 20.0 p -110.07 154.14 23.66 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.228 -0.442 . . . . 63.240000000000002 111.138 -179.963 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 20.5 tt0 -51.91 -38.84 57.78 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.222 -0.445 . . . . 64.430000000000007 110.895 -179.994 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.33 -31.61 64.08 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.127 -0.488 . . . . 73.040000000000006 111.075 179.9 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -72.77 -52.6 14.39 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.209 -0.45 . . . . 65.409999999999997 110.895 -179.9 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.456 HD22 HD12 ' A' ' 32' ' ' LEU . 9.3 mt -55.15 -38.39 68.2 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.128 -0.487 . . . . 74.439999999999998 110.928 -179.952 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 17.7 tp60 -64.48 -31.72 73.05 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.145 -0.48 . . . . 71.150000000000006 110.935 179.916 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 26.4 t0 -72.65 -42.11 64.71 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.204 -0.453 . . . . 73.420000000000002 110.864 179.969 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 41.6 mtp -65.71 -57.4 8.12 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.179 -0.464 . . . . 71.239999999999995 110.907 179.963 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.424 ' CD1' HG23 ' A' ' 29' ' ' THR . 62.0 mt -53.27 -45.64 55.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.216 -0.447 . . . . 64.319999999999993 111.155 179.941 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 83.0 m-20 -62.71 -29.76 70.9 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.204 -0.453 . . . . 73.420000000000002 110.891 179.915 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.36 -22.68 61.11 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.221 -0.445 . . . . 72.140000000000001 110.885 -179.983 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 35.7 m -112.96 6.28 8.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.128 -0.487 . . . . 60.25 111.176 179.963 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 30.2 t0 -86.15 97.75 10.51 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.137 -0.483 . . . . 73.420000000000002 110.891 179.923 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.28 -41.35 12.96 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.225 -0.443 . . . . 62.520000000000003 111.064 -179.993 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 57.7 p-10 -85.71 -0.13 54.32 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.197 -0.456 . . . . 74.120000000000005 110.872 -179.993 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 54.27 56.62 20.62 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.731 -0.747 . . . . 73.230000000000004 112.534 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 51.6 p-10 -114.4 -15.74 12.05 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.929 0.395 . . . . 75.120000000000005 110.914 -179.872 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 90.21 18.99 47.92 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.77 -0.729 . . . . 72.109999999999999 112.465 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . 0.661 ' CG2' HG22 ' A' ' 28' ' ' THR . 73.7 p -150.67 163.81 37.63 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.753 0.311 . . . . 74.049999999999997 111.131 -179.881 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 21.7 mt -97.96 111.05 26.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.207 -0.452 . . . . 45.43 111.122 179.909 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -78.43 -172.57 2.93 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.137 -0.483 . . . . 75.120000000000005 110.865 179.875 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.541 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 2.4 t80 -65.41 -57.67 14.17 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.623 0.725 . . . . 63.5 110.891 -179.926 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . 0.541 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 53.6 Cg_endo -69.78 -23.52 30.61 Favored 'Trans proline' 0 N--CA 1.465 -0.148 0 C-N-CA 122.717 2.278 . . . . 54.310000000000002 112.337 -180.0 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 15.2 mt-10 -64.45 -43.09 95.36 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.227 -0.442 . . . . 73.209999999999994 110.856 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 41.0 t80 -71.32 -36.76 71.71 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.148 -0.478 . . . . 72.219999999999999 110.866 -179.897 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.668 HD22 HG23 ' A' ' 9' ' ' ILE . 57.0 tp -70.87 -53.88 13.54 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.123 -0.49 . . . . 63.509999999999998 110.929 -179.98 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . 0.511 HG22 ' O ' ' A' ' 66' ' ' PRO . 12.8 t -59.92 -26.83 66.25 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.148 -0.478 . . . . 54.509999999999998 111.159 179.935 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 10.1 tmm? -63.33 -51.15 67.19 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.201 -0.454 . . . . 70.150000000000006 110.86 179.923 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -50.89 -45.68 60.2 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.252 -0.431 . . . . 74.510000000000005 110.883 179.936 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.194 -0.457 . . . . 63.310000000000002 111.113 179.929 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.762 HG21 HG22 ' A' ' 142' ' ' VAL . 39.1 mt . . . . . 0 N--CA 1.457 -0.099 0 CA-C-O 120.823 0.344 . . . . 74.219999999999999 111.13 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 13.9 ttt180 -59.95 -41.72 92.47 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.17 -0.468 . . . . 71.209999999999994 110.867 179.962 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.693 ' O ' HG23 ' A' ' 91' ' ' VAL . 28.3 tt0 -52.11 -47.86 65.06 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.213 -0.449 . . . . 74.540000000000006 110.872 -179.946 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . 0.505 ' HB1' ' CE2' ' A' ' 92' ' ' PHE . . . -74.55 -50.04 19.57 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.134 -0.485 . . . . 75.439999999999998 111.087 179.936 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 4.3 t80 -51.92 -34.53 42.01 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.231 -0.441 . . . . 63.039999999999999 110.838 -179.902 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -72.93 -46.01 54.89 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.156 -0.475 . . . . 73.349999999999994 110.903 -179.884 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . 0.693 HG23 ' O ' ' A' ' 87' ' ' GLU . 65.1 t -61.16 -31.01 48.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.181 -0.463 . . . . 74.5 111.156 179.922 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.697 ' CE1' HG11 ' A' ' 108' ' ' VAL . 21.0 m-85 -86.42 -44.07 12.32 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.156 -0.475 . . . . 74.150000000000006 110.93 179.972 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 44.2 t0 -67.78 87.95 0.24 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.123 -0.489 . . . . 64.310000000000002 110.866 179.979 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 2.3 tppt? -78.56 -47.16 17.79 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.212 -0.449 . . . . 63.43 110.863 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 9.5 p30 -72.65 -9.06 58.16 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.236 -0.438 . . . . 75.420000000000002 110.858 179.901 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 60.35 31.16 73.02 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.729 -0.748 . . . . 62.310000000000002 112.487 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 34.0 p-10 -81.89 -16.15 51.59 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.863 0.363 . . . . 75.230000000000004 110.879 -179.87 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 81.88 18.65 67.22 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.681 -0.771 . . . . 64.329999999999998 112.479 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 14.1 m-85 -142.49 142.93 32.36 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.852 0.358 . . . . 72.25 110.887 -179.808 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 62.3 mt -108.0 130.49 60.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.072 -0.513 . . . . 72.140000000000001 111.13 179.945 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 96.6 p -115.24 -171.76 2.01 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.201 -0.454 . . . . 62.329999999999998 110.86 -179.908 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . 0.607 ' HB2' HG13 ' A' ' 125' ' ' ILE . . . -76.15 -40.12 53.38 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.136 -0.484 . . . . 73.329999999999998 111.079 179.95 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -64.16 -37.95 89.31 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.168 -0.469 . . . . 64.409999999999997 111.106 179.962 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . 0.737 ' O ' HG23 ' A' ' 108' ' ' VAL . 56.6 mt-10 -67.83 -50.27 57.64 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.221 -0.445 . . . . 64.519999999999996 110.885 -179.948 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.554 HD11 HD13 ' M' ' 19' ' ' ILE . 22.1 tp -55.25 -54.86 38.08 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.12 -0.491 . . . . 74.5 110.877 -179.938 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . 0.444 ' O ' HG23 ' A' ' 110' ' ' THR . 37.0 ttp180 -52.24 -44.81 65.04 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.224 -0.443 . . . . 75.319999999999993 110.884 179.971 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 67.3 t60 -59.48 -34.38 72.5 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.149 -0.478 . . . . 70.510000000000005 110.892 179.969 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.737 HG23 ' O ' ' A' ' 104' ' ' GLU . 21.7 t -74.49 -52.37 19.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.196 -0.456 . . . . 64.310000000000002 111.142 179.977 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' MET . . . . . 0.747 ' HG2' HD11 ' A' ' 116' ' ' LEU . 0.3 OUTLIER -60.41 -41.94 94.97 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.148 -0.478 . . . . 73.140000000000001 110.901 179.896 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . 0.444 HG23 ' O ' ' A' ' 106' ' ' ARG . 11.3 p -53.51 -32.35 50.0 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.192 -0.458 . . . . 74.430000000000007 111.088 -179.936 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 22.6 t-20 -74.6 -29.41 61.3 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.243 -0.435 . . . . 74.420000000000002 110.876 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 2.1 mt -70.68 -24.36 62.66 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.219 -0.446 . . . . 64.140000000000001 110.905 179.944 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 101.02 32.93 5.14 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.765 -0.731 . . . . 64.030000000000001 112.531 179.924 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -112.4 114.54 27.31 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.917 0.389 . . . . 71.510000000000005 110.874 -179.832 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 3.2 ttpm? -64.61 123.35 19.07 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.158 -0.474 . . . . 64.219999999999999 110.881 179.947 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.747 HD11 ' HG2' ' A' ' 109' ' ' MET . 8.5 mt -141.34 155.79 45.91 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.181 -0.463 . . . . 70.340000000000003 110.926 179.901 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 30.3 p -118.87 167.47 11.68 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.227 -0.442 . . . . 54.399999999999999 111.177 179.911 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 69.8 m-20 -51.98 -37.53 53.43 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.218 -0.447 . . . . 73.329999999999998 110.852 179.927 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -72.67 -34.85 67.5 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.2 -0.454 . . . . 74.439999999999998 110.881 -179.891 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -64.91 -45.87 84.1 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.178 -0.465 . . . . 61.43 110.842 -179.917 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.487 ' CG1' ' HB1' ' A' ' 102' ' ' ALA . 88.9 t -56.21 -30.65 30.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.179 -0.464 . . . . 63.329999999999998 111.153 179.98 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 54.8 t0 -66.52 -45.67 78.73 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.173 -0.467 . . . . 73.140000000000001 110.864 179.921 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -55.82 -29.48 59.86 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.213 -0.449 . . . . 72.109999999999999 110.906 -179.914 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 25.1 mtp -75.76 -59.51 2.72 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.171 -0.468 . . . . 74.530000000000001 110.896 179.935 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.607 HG13 ' HB2' ' A' ' 102' ' ' ALA . 34.2 mm -54.08 -35.61 29.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.243 -0.435 . . . . 64.420000000000002 111.156 179.981 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 4.9 tmm_? -66.3 -31.72 72.69 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.135 -0.484 . . . . 75.299999999999997 110.873 179.953 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -70.67 -48.22 55.93 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.231 -0.44 . . . . 74.239999999999995 110.897 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.543 ' HB3' ' CG2' ' A' ' 136' ' ' VAL . . . -73.12 -33.05 65.32 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.175 -0.466 . . . . 43.439999999999998 111.1 179.931 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 50.6 t0 -69.18 86.31 0.39 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.196 -0.456 . . . . 71.400000000000006 110.898 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 130' ' ' ILE . . . . . 0.669 HD12 ' HG2' ' A' ' 140' ' ' GLU . 3.5 mt -79.95 -45.24 22.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.219 -0.446 . . . . 62.25 111.131 179.998 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 23.3 p30 -72.65 -8.9 57.6 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.188 -0.46 . . . . 74.030000000000001 110.881 179.855 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 62.94 45.36 95.82 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.747 -0.74 . . . . 52.420000000000002 112.506 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 31.6 p-10 -91.65 -16.15 27.46 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.894 0.378 . . . . 73.129999999999995 110.885 -179.957 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 101.94 3.8 51.7 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.73 -0.747 . . . . 64.409999999999997 112.489 -179.937 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 5.8 tt0 -149.34 172.31 15.11 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.832 0.349 . . . . 71.120000000000005 110.917 -179.882 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 136' ' ' VAL . . . . . 0.543 ' CG2' ' HB3' ' A' ' 128' ' ' ALA . 67.8 t -115.55 114.29 45.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.185 -0.461 . . . . 65.340000000000003 111.099 179.967 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 48.4 p-10 -94.01 -172.41 2.83 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.123 -0.489 . . . . 70.129999999999995 110.899 179.979 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 138' ' ' TYR . . . . . 0.732 ' O ' HG23 ' A' ' 142' ' ' VAL . 47.5 t80 -68.46 -49.26 61.15 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.185 -0.461 . . . . 74.140000000000001 110.918 -179.927 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -51.63 -46.68 63.73 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.172 -0.467 . . . . 64.510000000000005 110.884 179.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 140' ' ' GLU . . . . . 0.669 ' HG2' HD12 ' A' ' 130' ' ' ILE . 97.5 mt-10 -70.87 -40.86 72.03 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.162 -0.472 . . . . 72.109999999999999 110.929 -179.949 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 88.0 t80 -59.68 -35.5 74.58 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.12 -0.491 . . . . 70.319999999999993 110.917 -179.969 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . 0.762 HG22 HG21 ' A' ' 85' ' ' ILE . 94.2 t -64.1 -37.52 80.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.104 -0.498 . . . . 33.329999999999998 111.112 -179.99 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 16.4 tm0? -70.34 -33.13 71.11 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.152 -0.477 . . . . 64.409999999999997 110.951 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 8.8 tpt -74.71 -56.31 4.93 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.225 -0.443 . . . . 71.140000000000001 110.885 179.919 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 5.0 ttm -60.54 -27.91 68.02 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.216 -0.447 . . . . 73.430000000000007 110.906 179.952 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 2.5 m . . . . . 0 C--N 1.329 -0.286 0 CA-C-N 116.209 -0.45 . . . . 63.409999999999997 111.116 -179.924 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' M' M ' 15' ' ' LYS . . . . . . . . . . . . . 19.2 mtmm . . . . . 0 C--O 1.231 0.099 0 CA-C-O 120.774 0.321 . . . . 70.150000000000006 110.894 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' M' M ' 16' ' ' TRP . . . . . 0.783 ' CE3' HD12 ' M' ' 19' ' ' ILE . 17.9 m95 -52.06 -47.21 65.23 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.251 -0.432 . . . . 71.310000000000002 110.943 179.934 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' M' M ' 17' ' ' GLU . . . . . . . . . . . . . 18.1 tt0 -57.47 -26.22 60.92 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.282 -0.417 . . . . 74.510000000000005 110.892 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' M' M ' 18' ' ' LYS . . . . . . . . . . . . . 6.0 ttpm? -73.06 -25.8 61.05 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.11 -0.496 . . . . 73.319999999999993 110.885 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' M' M ' 19' ' ' ILE . . . . . 0.783 HD12 ' CE3' ' M' ' 16' ' ' TRP . 28.7 mt -76.64 -21.79 14.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.253 -0.431 . . . . 45.450000000000003 111.116 179.896 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' M' M ' 20' ' ' ARG . . . . . . . . . . . . . 43.1 ttt180 . . . . . 0 C--N 1.329 -0.285 0 CA-C-N 116.187 -0.46 . . . . 74.310000000000002 110.859 179.931 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' M' M ' 30' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.232 0.154 0 CA-C-O 120.789 0.328 . . . . 74.329999999999998 110.878 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' M' M ' 31' ' ' LEU . . . . . 0.665 HD12 HD12 ' M' ' 34' ' ' ILE . 12.3 tp -136.73 -41.25 0.61 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.226 -0.443 . . . . 51.119999999999997 110.924 179.886 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' M' M ' 32' ' ' LYS . . . . . . . . . . . . . 12.2 ptmm? -47.13 -42.15 18.79 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.247 -0.433 . . . . 64.239999999999995 110.911 179.791 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' M' M ' 33' ' ' HIS . . . . . . . . . . . . . 19.4 t60 -49.12 -44.4 42.33 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.218 -0.446 . . . . 73.430000000000007 110.843 179.871 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' M' M ' 34' ' ' ILE . . . . . 0.665 HD12 HD12 ' M' ' 31' ' ' LEU . 77.7 mt -51.54 -38.34 20.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.199 -0.455 . . . . 52.240000000000002 111.168 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' M' M ' 35' ' ' VAL . . . . . . . . . . . . . 38.1 t -50.14 -39.17 15.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.195 -0.457 . . . . 73.519999999999996 111.08 179.872 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' M' M ' 36' ' ' TRP . . . . . . . . . . . . . 22.5 m0 -59.06 -39.13 81.11 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.182 -0.463 . . . . 75.219999999999999 110.907 179.966 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' M' M ' 37' ' ' ALA . . . . . 1.011 ' HB3' HD13 ' A' ' 39' ' ' LEU . . . -64.22 -18.52 64.59 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.222 -0.445 . . . . 72.040000000000006 111.099 179.939 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' M' M ' 38' ' ' SER . . . . . 0.427 ' HB3' HD23 ' A' ' 18' ' ' LEU . 0.7 OUTLIER -73.13 -17.87 61.35 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.215 -0.448 . . . . 61.240000000000002 110.817 -179.744 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' M' M ' 39' ' ' ARG . . . . . . . . . . . . . 1.4 tpt180 -58.68 -25.6 63.0 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.165 -0.47 . . . . 74.510000000000005 110.897 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' M' M ' 40' ' ' GLU . . . . . . . . . . . . . 2.4 pt-20 -87.07 -27.89 22.88 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.142 -0.481 . . . . 72.219999999999999 110.894 -179.939 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' M' M ' 41' ' ' LEU . . . . . 0.681 HD21 ' OG ' ' A' ' 38' ' ' SER . 11.3 mt . . . . . 0 C--N 1.329 -0.32 0 CA-C-N 116.147 -0.478 . . . . 72.239999999999995 110.923 179.993 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 24.6 tt0 . . . . . 0 C--O 1.232 0.15 0 CA-C-O 120.764 0.316 . . . . 74.420000000000002 110.904 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 3.2 mp -62.66 -52.33 61.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.235 -0.439 . . . . 75.219999999999999 111.077 -179.976 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -52.0 -33.76 39.74 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.187 -0.461 . . . . 74.450000000000003 111.114 179.8 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -74.9 -51.66 13.28 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.192 -0.458 . . . . 72.209999999999994 110.864 -179.897 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 16.5 m-85 -58.2 -42.22 85.69 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.17 -0.468 . . . . 53.310000000000002 110.891 -179.899 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -51.91 -37.85 54.04 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.131 -0.486 . . . . 72.409999999999997 110.892 179.986 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 -66.13 -35.83 81.52 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.252 -0.431 . . . . 50.130000000000003 110.831 179.978 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -65.63 -41.06 93.08 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.164 -0.471 . . . . 73.140000000000001 111.078 179.943 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.406 ' CE1' HD11 ' A' ' 27' ' ' ILE . 85.3 t80 -53.4 -51.58 62.1 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.253 -0.43 . . . . 72.439999999999998 110.881 -179.927 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 14.7 p -53.23 -32.71 49.63 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.176 -0.465 . . . . 64.439999999999998 110.857 -179.824 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 17.5 tp -64.58 -38.92 92.68 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.141 -0.481 . . . . 74.25 110.879 -179.991 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.642 ' CE1' HG11 ' A' ' 35' ' ' VAL . 48.1 m-85 -82.04 -27.65 32.92 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.233 -0.44 . . . . 75.120000000000005 110.888 179.966 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -82.83 98.56 9.21 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.164 -0.471 . . . . 54.25 110.835 179.962 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 40.4 mmtt -69.91 -54.14 14.73 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.197 -0.456 . . . . 73.349999999999994 110.878 179.969 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 22.3 p-10 -77.2 -10.12 59.21 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.215 -0.448 . . . . 72.310000000000002 110.879 179.879 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 52.02 42.26 54.07 Favored Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.726 -0.75 . . . . 73.409999999999997 112.453 -179.959 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 29.9 p-10 -88.57 -15.66 34.53 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.872 0.367 . . . . 71.109999999999999 110.882 -179.998 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 105.4 -11.74 47.36 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.723 -0.751 . . . . 74.120000000000005 112.463 -179.965 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 34.0 p -125.8 130.78 52.1 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.723 0.297 . . . . 54.43 111.168 -179.818 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.532 HG22 ' HB2' ' A' ' 32' ' ' LEU . 25.0 mt -98.58 125.98 51.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.241 -0.436 . . . . 74.439999999999998 111.108 179.969 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.762 HG22 HG22 ' A' ' 62' ' ' THR . 73.9 p -111.41 -178.51 3.47 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.188 -0.46 . . . . 72.310000000000002 111.1 -179.998 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.521 HG23 ' CD1' ' A' ' 52' ' ' ILE . 2.0 p -66.57 -26.76 67.27 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.214 -0.448 . . . . 71.239999999999995 111.147 -179.966 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 2.2 tppp? -75.07 -50.19 17.25 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.224 -0.444 . . . . 71.409999999999997 110.883 179.878 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 28.4 mt-10 -71.32 -40.38 70.8 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.266 -0.425 . . . . 74.150000000000006 110.843 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.532 ' HB2' HG22 ' A' ' 27' ' ' ILE . 3.9 tt -74.07 -49.19 25.18 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.199 -0.455 . . . . 61.229999999999997 110.921 -179.988 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -54.25 -27.94 41.13 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.771 -0.728 . . . . 73.010000000000005 112.453 179.93 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 95.1 m -68.97 -53.47 20.53 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.827 0.346 . . . . 75.140000000000001 111.095 -179.828 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.642 HG11 ' CE1' ' A' ' 19' ' ' PHE . 39.2 t -51.76 -51.42 27.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.223 -0.444 . . . . 60.409999999999997 111.172 179.89 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 7.5 mtt -54.21 -49.14 70.09 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.126 -0.488 . . . . 71.319999999999993 110.859 179.94 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 2.6 tmt_? -59.1 -42.6 90.87 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.205 -0.452 . . . . 62.210000000000001 110.887 -179.929 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . 0.632 ' OG ' HD21 ' M' ' 41' ' ' LEU . 4.2 t -57.5 -29.9 64.68 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.14 -0.482 . . . . 72.409999999999997 110.859 -179.785 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.992 HD13 ' HB3' ' M' ' 37' ' ' ALA . 9.3 mt -91.91 -4.38 54.78 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.13 -0.486 . . . . 74.109999999999999 110.957 179.988 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 101.42 -13.15 58.4 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.738 -0.744 . . . . 73.150000000000006 112.523 179.943 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -81.48 96.27 7.35 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.855 0.359 . . . . 71.420000000000002 110.917 -179.883 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 6.4 t-20 -109.74 82.67 2.4 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.672 0.749 . . . . 62.210000000000001 110.874 -179.952 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.8 168.05 22.72 Favored 'Trans proline' 0 C--N 1.342 0.187 0 C-N-CA 122.719 2.279 . . . . 45.32 112.332 179.949 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 20.0 p -83.98 158.35 21.55 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.224 -0.443 . . . . 72.310000000000002 111.128 -179.947 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 15.1 mp0 -51.97 -48.36 64.38 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.228 -0.442 . . . . 60.0 110.914 179.98 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.78 -31.55 72.59 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.159 -0.473 . . . . 63.409999999999997 111.062 179.967 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -68.28 -52.0 38.73 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.259 -0.428 . . . . 74.439999999999998 110.915 -179.908 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 25.3 mt -55.09 -48.67 73.24 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.122 -0.49 . . . . 72.040000000000006 110.904 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 17.5 tp60 -54.4 -29.43 48.93 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.212 -0.449 . . . . 64.5 110.91 179.932 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . 0.73 ' OD2' HG21 ' A' ' 146' ' ' THR . 46.1 t0 -74.49 -29.53 61.46 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.189 -0.46 . . . . 73.420000000000002 110.862 179.989 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . 0.619 ' HE2' HD13 ' M' ' 31' ' ' LEU . 41.5 mtp -73.14 -58.06 3.58 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.174 -0.467 . . . . 70.340000000000003 110.857 -179.974 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.521 ' CD1' HG23 ' A' ' 29' ' ' THR . 62.0 mt -53.32 -52.75 28.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.22 -0.446 . . . . 72.200000000000003 111.105 179.981 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 78.4 m-20 -57.0 -25.28 58.21 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.236 -0.438 . . . . 71.519999999999996 110.894 179.967 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -75.54 -28.33 59.02 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.145 -0.48 . . . . 63.240000000000002 110.87 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 9.8 m -109.81 10.87 8.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.164 -0.471 . . . . 60.530000000000001 111.104 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 28.8 t0 -86.69 99.99 12.15 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.199 -0.455 . . . . 62.039999999999999 110.869 179.89 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.3 -46.87 8.85 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.163 -0.471 . . . . 70.349999999999994 111.126 179.911 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 50.7 p30 -81.63 -0.3 41.84 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.226 -0.443 . . . . 71.340000000000003 110.88 -179.998 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 55.26 55.47 28.19 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.734 -0.746 . . . . 43.0 112.517 -179.916 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 50.3 p-10 -114.55 -15.76 11.97 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.863 0.363 . . . . 43.329999999999998 110.872 -179.858 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 89.39 20.46 44.98 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.705 -0.76 . . . . 64.329999999999998 112.527 -179.981 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . 0.762 HG22 HG22 ' A' ' 28' ' ' THR . 71.4 p -150.49 161.1 43.18 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.723 0.296 . . . . 73.040000000000006 111.117 -179.814 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.429 HG21 ' HD1' ' A' ' 68' ' ' PHE . 22.9 mt -98.98 114.59 37.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.214 -0.448 . . . . 71.409999999999997 111.151 179.882 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.4 t0 -82.33 -172.84 4.22 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.213 -0.449 . . . . 74.439999999999998 110.86 179.902 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.529 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 2.4 t80 -65.1 -58.21 13.23 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.65 0.738 . . . . 65.140000000000001 110.867 -179.89 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . 0.529 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 53.9 Cg_endo -69.74 -24.26 29.98 Favored 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.674 2.25 . . . . 52.229999999999997 112.315 -179.968 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 75.9 mt-10 -65.29 -41.78 93.8 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.254 -0.43 . . . . 73.129999999999995 110.917 -179.964 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . 0.429 ' HD1' HG21 ' A' ' 63' ' ' ILE . 26.5 t80 -72.54 -36.11 68.19 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.148 -0.478 . . . . 63.520000000000003 110.863 -179.932 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 50.2 tp -68.98 -53.67 19.39 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.137 -0.483 . . . . 74.349999999999994 110.901 -179.973 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 13.3 t -58.44 -26.67 63.58 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.242 -0.436 . . . . 64.329999999999998 111.137 179.936 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 5.3 tmm? -62.25 -50.41 71.84 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.243 -0.435 . . . . 72.319999999999993 110.868 179.94 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 1.2 mmt -51.61 -45.39 63.2 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.215 -0.448 . . . . 74.219999999999999 110.88 179.951 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.313 0 CA-C-N 116.238 -0.437 . . . . 61.229999999999997 111.1 179.967 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.462 HG23 ' CE1' ' A' ' 141' ' ' PHE . 61.9 mt . . . . . 0 C--O 1.231 0.112 0 CA-C-O 120.85 0.357 . . . . 42.399999999999999 111.142 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 53.6 ttp180 -72.02 -32.92 67.63 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.193 -0.458 . . . . 74.129999999999995 110.871 179.975 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 24.9 mm-40 -76.56 -48.29 19.78 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.165 -0.471 . . . . 74.409999999999997 110.939 -179.975 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -53.37 -43.01 67.44 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.182 -0.463 . . . . 74.340000000000003 111.122 179.883 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.402 ' CD1' HD11 ' A' ' 100' ' ' ILE . 36.0 t80 -52.01 -37.28 52.76 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.244 -0.434 . . . . 71.109999999999999 110.875 -179.937 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 3.4 tmt_? -71.0 -38.67 72.66 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.128 -0.487 . . . . 74.329999999999998 110.845 -179.888 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 31.5 t -62.21 -48.13 89.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.196 -0.456 . . . . 75.420000000000002 111.13 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.496 ' CE1' HG11 ' A' ' 108' ' ' VAL . 9.9 m-85 -68.3 -26.3 65.57 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.186 -0.461 . . . . 73.150000000000006 110.875 -179.987 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 37.6 t0 -72.84 92.81 1.63 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.151 -0.477 . . . . 75.409999999999997 110.873 179.948 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 34.4 ttmt -78.57 -51.02 10.53 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.192 -0.458 . . . . 62.299999999999997 110.882 179.985 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 24.0 p30 -72.44 -9.1 58.11 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.228 -0.442 . . . . 61.329999999999998 110.866 179.87 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 60.0 29.37 67.86 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.779 -0.724 . . . . 70.120000000000005 112.482 -179.951 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 42.6 p-10 -82.98 -16.15 48.37 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.91 0.386 . . . . 73.430000000000007 110.908 -179.884 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 93.66 18.7 37.13 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.709 -0.757 . . . . 74.209999999999994 112.469 179.965 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 21.8 m-85 -139.26 165.56 26.86 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.884 0.373 . . . . 74.299999999999997 110.909 -179.799 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.402 HD11 ' CD1' ' A' ' 89' ' ' PHE . 77.5 mt -122.37 114.56 43.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.135 -0.484 . . . . 62.329999999999998 111.126 179.91 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 4.9 p -102.52 174.93 5.68 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.174 -0.466 . . . . 72.530000000000001 110.906 -179.927 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . 0.54 ' HB2' HG13 ' A' ' 125' ' ' ILE . . . -67.73 -30.2 69.62 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.191 -0.459 . . . . 61.009999999999998 111.124 179.889 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -68.13 -43.91 77.27 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.17 -0.468 . . . . 34.32 111.15 179.912 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 91.0 mt-10 -74.13 -47.68 34.52 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.193 -0.458 . . . . 71.439999999999998 110.875 -179.934 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 34.8 tp -53.86 -49.78 67.72 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.159 -0.473 . . . . 73.209999999999994 110.916 -179.944 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . 0.471 ' HB2' HG21 ' A' ' 121' ' ' VAL . 26.3 ttt180 -52.25 -41.62 62.96 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.191 -0.458 . . . . 52.409999999999997 110.876 179.923 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 27.3 t60 -59.74 -34.47 72.99 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.232 -0.44 . . . . 75.209999999999994 110.903 179.984 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.496 HG11 ' CE1' ' A' ' 92' ' ' PHE . 38.3 t -66.86 -45.71 86.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.193 -0.458 . . . . 53.140000000000001 111.153 179.956 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 109' ' ' MET . . . . . 0.471 ' HB3' HD12 ' A' ' 116' ' ' LEU . 3.4 mmt -60.59 -37.0 79.91 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.186 -0.461 . . . . 63.409999999999997 110.85 179.939 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 2.1 m -55.03 -34.33 63.41 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.236 -0.438 . . . . 71.040000000000006 111.152 -179.948 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 4.9 t-20 -70.96 -30.69 67.05 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.22 -0.446 . . . . 62.409999999999997 110.87 179.974 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.434 HD13 ' HE2' ' M' ' 18' ' ' LYS . 18.1 mt -73.01 -26.28 61.27 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.189 -0.46 . . . . 63.229999999999997 110.918 179.967 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 99.9 30.13 6.56 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.767 -0.73 . . . . 52.439999999999998 112.465 179.874 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -115.14 112.69 22.94 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.915 0.388 . . . . 62.310000000000002 110.87 -179.876 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.57 119.77 12.28 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.127 -0.488 . . . . 62.219999999999999 110.87 179.951 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.471 HD12 ' HB3' ' A' ' 109' ' ' MET . 7.8 mt -140.49 155.82 46.54 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.215 -0.448 . . . . 74.140000000000001 110.891 179.883 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . 0.631 ' O ' HG23 ' A' ' 121' ' ' VAL . 52.5 p -115.03 170.54 8.27 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.181 -0.463 . . . . 74.109999999999999 111.141 179.958 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 20.6 m-20 -58.71 -33.21 69.94 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.215 -0.448 . . . . 75.409999999999997 110.857 179.909 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 22.5 tp10 -75.68 -33.46 60.39 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.184 -0.462 . . . . 72.340000000000003 110.865 -179.882 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 13.7 tt0 -71.15 -31.77 68.12 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.171 -0.468 . . . . 61.350000000000001 110.856 -179.914 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.631 HG23 ' O ' ' A' ' 117' ' ' THR . 43.5 t -71.27 -31.96 45.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.187 -0.461 . . . . 63.409999999999997 111.153 179.963 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 12.2 t0 -51.98 -46.86 65.02 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.137 -0.483 . . . . 65.340000000000003 110.811 179.954 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 20.6 tp10 -55.82 -29.33 59.6 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.214 -0.448 . . . . 71.510000000000005 110.877 -179.859 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 71.7 mtp -75.55 -59.48 2.73 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.144 -0.48 . . . . 73.040000000000006 110.903 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.54 HG13 ' HB2' ' A' ' 102' ' ' ALA . 35.9 mm -53.93 -35.7 28.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.243 -0.435 . . . . 61.329999999999998 111.165 179.898 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 56.8 ttt180 -63.49 -31.85 73.13 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.152 -0.476 . . . . 73.129999999999995 110.915 179.932 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -74.66 -52.37 11.83 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.139 -0.482 . . . . 74.329999999999998 110.864 -179.892 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.673 ' HB3' HG22 ' A' ' 136' ' ' VAL . . . -65.23 -34.49 78.48 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.102 -0.499 . . . . 55.43 111.099 179.925 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 49.4 t0 -68.45 86.74 0.3 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.26 -0.427 . . . . 70.430000000000007 110.864 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 55.2 mt -79.83 -46.13 22.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.166 -0.47 . . . . 72.140000000000001 111.141 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 21.3 p30 -72.8 -8.74 56.94 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.181 -0.463 . . . . 65.540000000000006 110.875 179.864 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 62.76 42.59 99.66 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.703 -0.761 . . . . 74.129999999999995 112.476 -179.917 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 34.6 p-10 -87.58 -16.0 35.8 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.864 0.364 . . . . 71.340000000000003 110.919 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 104.12 2.37 45.11 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.745 -0.741 . . . . 74.439999999999998 112.431 -179.988 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 4.0 tt0 -149.16 172.27 15.09 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.901 0.382 . . . . 73.409999999999997 110.894 -179.921 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 136' ' ' VAL . . . . . 0.673 HG22 ' HB3' ' A' ' 128' ' ' ALA . 99.3 t -107.33 111.25 34.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.21 -0.45 . . . . 51.219999999999999 111.127 179.98 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 19.0 p30 -92.11 165.59 13.08 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.15 -0.477 . . . . 74.150000000000006 110.881 -179.993 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 138' ' ' TYR . . . . . 0.43 ' O ' HG23 ' A' ' 142' ' ' VAL . 37.0 t80 -52.01 -46.89 65.15 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.162 -0.472 . . . . 64.329999999999998 110.983 -179.919 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 15.3 tt0 -51.94 -42.14 62.6 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.077 -0.51 . . . . 65.340000000000003 110.943 179.965 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 23.7 mt-10 -76.52 -34.27 58.58 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.108 -0.497 . . . . 71.409999999999997 110.92 -179.951 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . 0.462 ' CE1' HG23 ' A' ' 85' ' ' ILE . 43.2 t80 -65.74 -38.93 90.48 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.121 -0.49 . . . . 54.420000000000002 110.855 -179.897 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . 0.43 HG23 ' O ' ' A' ' 138' ' ' TYR . 98.9 t -71.34 -40.6 73.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.121 -0.491 . . . . 64.299999999999997 111.123 -179.989 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 24.4 tt0 -70.83 -45.31 64.78 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.173 -0.467 . . . . 61.100000000000001 110.911 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 11.4 tpt -65.0 -26.2 68.19 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.172 -0.467 . . . . 73.049999999999997 110.87 180.0 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 145' ' ' MET . . . . . 0.447 ' HE1' HG22 ' M' ' 19' ' ' ILE . 6.4 ttm -87.61 -39.47 15.04 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.25 -0.432 . . . . 64.530000000000001 110.887 179.916 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 146' ' ' THR . . . . . 0.73 HG21 ' OD2' ' A' ' 50' ' ' ASP . 2.6 m . . . . . 0 C--N 1.329 -0.286 0 CA-C-N 116.197 -0.456 . . . . 72.430000000000007 111.113 -179.87 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' M' M ' 15' ' ' LYS . . . . . . . . . . . . . 44.7 mttp . . . . . 0 C--O 1.231 0.112 0 CA-C-O 120.779 0.323 . . . . 62.450000000000003 110.888 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' M' M ' 16' ' ' TRP . . . . . . . . . . . . . 10.2 m95 -54.09 -39.03 65.96 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.241 -0.436 . . . . 71.019999999999996 110.919 179.923 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' M' M ' 17' ' ' GLU . . . . . . . . . . . . . 15.3 tm-20 -56.9 -27.8 61.15 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.227 -0.442 . . . . 74.420000000000002 110.872 -179.929 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' M' M ' 18' ' ' LYS . . . . . 0.434 ' HE2' HD13 ' A' ' 112' ' ' LEU . 6.9 ttpm? -73.45 -26.95 61.16 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.153 -0.476 . . . . 62.100000000000001 110.913 179.953 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' M' M ' 19' ' ' ILE . . . . . 0.447 HG22 ' HE1' ' A' ' 145' ' ' MET . 27.6 mt -93.02 -23.45 5.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.25 -0.432 . . . . 64.299999999999997 111.169 179.848 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' M' M ' 20' ' ' ARG . . . . . . . . . . . . . 25.5 ttp85 . . . . . 0 C--N 1.329 -0.284 0 CA-C-N 116.193 -0.458 . . . . 74.109999999999999 110.846 179.972 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' M' M ' 30' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.232 0.181 0 CA-C-O 120.798 0.332 . . . . 74.140000000000001 110.896 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' M' M ' 31' ' ' LEU . . . . . 0.619 HD13 ' HE2' ' A' ' 51' ' ' MET . 10.9 tp -147.95 -46.56 0.16 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.253 -0.431 . . . . 70.409999999999997 110.898 179.984 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' M' M ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.45 -32.83 8.31 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.169 -0.469 . . . . 64.430000000000007 110.919 179.866 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' M' M ' 33' ' ' HIS . . . . . . . . . . . . . 77.6 t60 -47.99 -47.17 33.23 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.226 -0.443 . . . . 72.409999999999997 110.846 179.919 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' M' M ' 34' ' ' ILE . . . . . 0.501 ' H ' HD12 ' M' ' 34' ' ' ILE . 3.6 mp -51.73 -38.75 22.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.169 -0.469 . . . . 71.430000000000007 111.137 179.967 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' M' M ' 35' ' ' VAL . . . . . . . . . . . . . 47.1 t -49.01 -39.63 12.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.203 -0.453 . . . . 74.200000000000003 111.138 179.826 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' M' M ' 36' ' ' TRP . . . . . . . . . . . . . 20.9 m0 -59.19 -40.21 85.03 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.197 -0.456 . . . . 73.310000000000002 110.923 179.972 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' M' M ' 37' ' ' ALA . . . . . 0.992 ' HB3' HD13 ' A' ' 39' ' ' LEU . . . -63.01 -18.77 63.68 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.231 -0.44 . . . . 51.409999999999997 111.09 179.912 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' M' M ' 38' ' ' SER . . . . . . . . . . . . . 5.0 m -64.92 -17.8 64.66 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.207 -0.451 . . . . 64.129999999999995 110.886 -179.803 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' M' M ' 39' ' ' ARG . . . . . . . . . . . . . 52.3 mtp180 -52.12 -29.2 20.77 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.123 -0.49 . . . . 70.040000000000006 110.88 -179.931 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' M' M ' 40' ' ' GLU . . . . . . . . . . . . . 17.7 tp10 -90.05 -48.08 7.42 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.205 -0.452 . . . . 71.299999999999997 110.887 -179.955 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' M' M ' 41' ' ' LEU . . . . . 0.632 HD21 ' OG ' ' A' ' 38' ' ' SER . 6.8 mt . . . . . 0 C--N 1.328 -0.333 0 CA-C-N 116.132 -0.485 . . . . 74.299999999999997 110.9 -179.958 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 32.4 tt0 . . . . . 0 C--O 1.231 0.094 0 CA-C-O 120.803 0.335 . . . . 74.030000000000001 110.921 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 54.3 mt -72.69 -45.8 56.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.184 -0.462 . . . . 73.239999999999995 111.105 179.962 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -52.0 -29.54 21.26 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.23 -0.441 . . . . 74.040000000000006 111.087 179.818 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 41.3 tp10 -73.87 -38.39 64.45 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.263 -0.426 . . . . 72.409999999999997 110.93 -179.958 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 30.3 m-85 -75.82 -46.02 32.76 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.108 -0.496 . . . . 73.140000000000001 110.854 -179.933 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 35.1 ttmt -60.63 -35.47 76.26 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.175 -0.466 . . . . 72.310000000000002 110.955 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 23.0 mt-10 -58.62 -37.73 76.51 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.228 -0.442 . . . . 75.400000000000006 110.911 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.418 ' HB1' HG13 ' M' ' 35' ' ' VAL . . . -71.43 -43.94 65.79 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.126 -0.488 . . . . 70.430000000000007 111.096 179.913 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 92.6 t80 -55.49 -53.97 49.76 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.254 -0.43 . . . . 72.5 110.868 -179.912 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 12.6 t -52.43 -30.41 29.34 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.177 -0.465 . . . . 72.409999999999997 110.887 -179.799 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.627 HD23 ' HB3' ' M' ' 38' ' ' SER . 15.6 tp -65.71 -42.19 91.43 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.099 -0.5 . . . . 54.450000000000003 110.878 -179.968 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 43.1 m-85 -75.43 -25.46 57.51 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.181 -0.463 . . . . 70.0 110.866 179.948 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 20.9 t0 -84.02 98.54 9.89 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.167 -0.469 . . . . 64.140000000000001 110.85 179.994 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 15.7 ttmm -71.11 -55.51 8.04 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.167 -0.47 . . . . 71.010000000000005 110.906 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 22.5 p-10 -72.19 -10.15 59.4 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.225 -0.443 . . . . 74.120000000000005 110.833 179.909 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 51.82 42.14 52.53 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.777 -0.725 . . . . 74.510000000000005 112.506 -179.9 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 27.5 p-10 -88.44 -15.8 34.48 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.824 0.345 . . . . 73.340000000000003 110.814 -179.967 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 104.98 -7.14 44.17 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.776 -0.726 . . . . 72.5 112.496 -179.907 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 2.8 p -131.79 130.83 42.34 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.737 0.304 . . . . 75.230000000000004 111.168 -179.862 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.58 HG21 HD23 ' A' ' 32' ' ' LEU . 28.7 mt -93.69 120.32 42.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.191 -0.459 . . . . 72.200000000000003 111.143 179.91 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.601 HG22 ' CG2' ' A' ' 62' ' ' THR . 20.3 p -101.43 175.46 5.56 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.164 -0.471 . . . . 72.019999999999996 111.146 179.948 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 33.7 p -62.36 -24.97 67.66 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.185 -0.461 . . . . 74.400000000000006 111.146 -179.97 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 31.3 mttm -73.09 -50.1 24.78 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.215 -0.448 . . . . 72.549999999999997 110.898 179.901 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.554 ' O ' HG23 ' A' ' 35' ' ' VAL . 46.2 mt-10 -73.74 -32.69 63.98 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.255 -0.43 . . . . 74.530000000000001 110.883 179.975 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.581 ' O ' HD13 ' A' ' 32' ' ' LEU . 0.9 OUTLIER -73.51 -40.87 63.71 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.16 -0.473 . . . . 72.150000000000006 110.919 179.99 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -71.73 -40.52 58.3 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.736 -0.745 . . . . 64.25 112.51 179.923 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 96.7 m -59.6 -56.09 26.24 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.825 0.345 . . . . 75.120000000000005 111.107 -179.852 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.554 HG23 ' O ' ' A' ' 31' ' ' GLU . 97.4 t -51.44 -50.11 29.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.247 -0.433 . . . . 72.519999999999996 111.139 179.908 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 3.0 mtp -52.07 -32.1 33.22 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.125 -0.489 . . . . 74.299999999999997 110.901 179.918 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 40.8 ttt-85 -64.4 -48.23 76.19 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.207 -0.451 . . . . 63.530000000000001 110.868 -179.919 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . 0.688 ' OG ' HD11 ' M' ' 41' ' ' LEU . 2.2 p -59.42 -28.81 67.27 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.176 -0.466 . . . . 15.35 110.834 -179.775 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 1.029 HD13 ' HB3' ' M' ' 37' ' ' ALA . 32.8 mt -80.32 -16.27 54.98 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.183 -0.462 . . . . 73.239999999999995 110.928 179.994 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 101.58 27.11 7.31 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.721 -0.752 . . . . 62.43 112.487 179.927 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 5.2 mt-30 -119.69 135.42 54.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.802 0.334 . . . . 62.5 110.894 -179.845 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 32.5 t-20 -109.79 76.76 0.97 Allowed Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 121.627 0.727 . . . . 63.32 110.914 -179.949 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.75 149.73 67.35 Favored 'Trans proline' 0 C--O 1.232 0.191 0 C-N-CA 122.634 2.223 . . . . 63.409999999999997 112.375 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 20.9 p -99.15 176.77 5.43 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.23 -0.441 . . . . 74.540000000000006 111.109 -179.925 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 36.1 mm-40 -64.83 -47.02 79.47 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.185 -0.461 . . . . 74.439999999999998 110.949 179.94 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.4 -38.94 65.43 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.158 -0.474 . . . . 71.430000000000007 111.047 179.94 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 13.2 tt0 -55.8 -52.65 63.24 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.267 -0.424 . . . . 75.019999999999996 110.896 -179.916 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.457 ' CD2' HD12 ' A' ' 32' ' ' LEU . 9.2 mt -57.59 -52.19 66.43 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.15 -0.477 . . . . 63.539999999999999 110.948 179.985 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.2 mm-40 -56.97 -28.5 62.36 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.21 -0.45 . . . . 72.120000000000005 110.88 179.933 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -63.98 -49.57 71.97 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.199 -0.455 . . . . 63.009999999999998 110.881 179.998 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . 0.64 ' SD ' HD13 ' M' ' 31' ' ' LEU . 6.7 ptp -75.71 -37.49 59.4 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.233 -0.439 . . . . 74.409999999999997 110.878 179.985 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 79.2 mt -65.31 -47.49 86.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.23 -0.441 . . . . 72.439999999999998 111.138 179.984 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 85.2 m-20 -58.39 -33.58 69.78 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.147 -0.479 . . . . 73.340000000000003 110.895 179.921 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 15.0 mm-40 -62.41 -51.02 69.2 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.178 -0.464 . . . . 73.129999999999995 110.901 -179.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 17.6 m -77.98 -15.0 14.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.125 -0.489 . . . . 62.240000000000002 111.143 179.97 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 39.1 t0 -66.75 95.19 0.34 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.172 -0.467 . . . . 64.530000000000001 110.89 179.877 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.26 -35.3 17.36 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.166 -0.47 . . . . 73.430000000000007 111.101 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -88.22 -0.13 56.76 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.199 -0.455 . . . . 70.010000000000005 110.852 -179.998 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 52.79 58.95 9.99 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.726 -0.749 . . . . 35.25 112.495 -179.954 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 51.8 p-10 -114.63 -15.78 11.92 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.836 0.351 . . . . 64.150000000000006 110.888 -179.899 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 93.25 18.54 38.91 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.755 -0.736 . . . . 74.299999999999997 112.471 179.961 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . 0.601 ' CG2' HG22 ' A' ' 28' ' ' THR . 63.9 p -150.76 170.77 18.44 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.754 0.312 . . . . 73.430000000000007 111.153 -179.855 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 21.5 mt -102.47 109.53 26.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.257 -0.429 . . . . 74.310000000000002 111.132 179.942 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -74.13 -172.86 1.48 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.18 -0.464 . . . . 73.299999999999997 110.869 179.866 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.54 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 2.5 t80 -65.38 -58.05 13.16 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.647 0.737 . . . . 73.25 110.908 -179.923 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . 0.54 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 53.2 Cg_endo -69.75 -25.92 28.14 Favored 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.725 2.283 . . . . 65.439999999999998 112.317 -179.97 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -63.23 -39.98 96.17 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.211 -0.45 . . . . 74.150000000000006 110.879 -179.956 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 44.9 t80 -74.5 -35.94 63.23 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.132 -0.485 . . . . 74.420000000000002 110.883 -179.909 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 21.9 tp -71.03 -54.14 12.24 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.183 -0.462 . . . . 72.420000000000002 110.879 -179.978 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 13.4 t -51.69 -30.01 20.45 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.202 -0.453 . . . . 61.030000000000001 111.168 179.904 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 37.7 ttp -59.72 -41.95 91.99 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.205 -0.452 . . . . 64.519999999999996 110.842 179.975 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 3.5 mtt -79.84 -28.87 40.03 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.228 -0.442 . . . . 73.329999999999998 110.865 179.952 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.28 0 CA-C-N 116.273 -0.421 . . . . 63.530000000000001 111.111 179.908 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.596 HG21 HG22 ' A' ' 142' ' ' VAL . 5.0 mp . . . . . 0 C--O 1.231 0.106 0 CA-C-O 120.807 0.337 . . . . 73.310000000000002 111.117 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 20.4 ttt-85 -61.68 -28.23 69.25 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.188 -0.46 . . . . 65.409999999999997 110.865 -179.992 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.672 ' O ' HG23 ' A' ' 91' ' ' VAL . 7.9 mm-40 -68.19 -48.33 65.54 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.193 -0.458 . . . . 75.319999999999993 110.932 -179.997 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . 0.75 ' HB1' ' CE2' ' A' ' 92' ' ' PHE . . . -74.04 -35.34 64.31 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.149 -0.478 . . . . 70.25 111.069 179.96 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 4.4 t80 -53.71 -47.78 70.2 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.256 -0.429 . . . . 75.129999999999995 110.863 -179.897 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 7.5 ptm180 -69.04 -25.95 64.73 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.131 -0.486 . . . . 73.430000000000007 110.875 -179.926 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . 0.672 HG23 ' O ' ' A' ' 87' ' ' GLU . 96.5 t -78.12 -27.4 14.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.194 -0.457 . . . . 74.5 111.131 179.988 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.75 ' CE2' ' HB1' ' A' ' 88' ' ' ALA . 21.9 m-85 -94.66 -26.14 16.45 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.134 -0.485 . . . . 72.510000000000005 110.888 -179.992 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 32.7 t0 -73.98 95.1 2.44 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.161 -0.472 . . . . 72.140000000000001 110.866 179.982 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 42.9 mmtt -78.68 -52.54 8.27 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.199 -0.455 . . . . 63.25 110.886 -180.0 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 52.1 p-10 -72.44 -9.15 58.17 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.211 -0.449 . . . . 64.450000000000003 110.838 179.917 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 59.79 28.37 65.59 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.709 -0.758 . . . . 73.299999999999997 112.487 -179.934 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 35.4 p-10 -81.77 -16.14 51.98 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.857 0.36 . . . . 50.229999999999997 110.881 -179.897 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 88.73 18.68 54.11 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.717 -0.754 . . . . 73.450000000000003 112.543 -179.952 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 23.6 m-85 -142.83 153.64 43.4 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.898 0.38 . . . . 72.129999999999995 110.918 -179.824 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.488 HD12 ' HD2' ' A' ' 141' ' ' PHE . 78.1 mt -119.25 127.04 75.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.089 -0.505 . . . . 72.219999999999999 111.133 179.954 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 6.4 p -112.44 -176.19 2.86 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.184 -0.462 . . . . 40.219999999999999 110.882 -179.946 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . 0.55 ' HB2' HG13 ' A' ' 125' ' ' ILE . . . -74.31 -27.49 60.73 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.149 -0.478 . . . . 72.340000000000003 111.144 179.9 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -72.01 -47.68 50.1 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.21 -0.45 . . . . 71.340000000000003 111.09 179.951 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -67.78 -46.07 73.02 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.209 -0.45 . . . . 70.409999999999997 110.897 -179.922 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.65 HD21 ' HE2' ' A' ' 124' ' ' MET . 21.2 tp -52.87 -39.56 62.74 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.109 -0.496 . . . . 75.530000000000001 110.936 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . 0.443 ' O ' HG23 ' A' ' 110' ' ' THR . 63.0 ttp85 -55.46 -38.7 69.41 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.177 -0.465 . . . . 74.319999999999993 110.874 179.939 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 40.8 t60 -66.83 -34.37 77.67 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.171 -0.468 . . . . 72.150000000000006 110.862 -179.989 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 88.6 t -72.0 -51.18 32.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.21 -0.45 . . . . 74.200000000000003 111.132 179.955 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 1.3 mmt -60.61 -43.72 97.12 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.184 -0.462 . . . . 75.239999999999995 110.869 179.929 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . 0.443 HG23 ' O ' ' A' ' 106' ' ' ARG . 9.7 p -54.03 -27.26 31.02 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.235 -0.439 . . . . 74.25 111.137 -179.929 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.9 t30 -70.78 -31.68 68.54 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.223 -0.444 . . . . 62.329999999999998 110.885 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.608 HD13 ' HE2' ' M' ' 18' ' ' LYS . 8.2 mt -71.19 -26.21 62.86 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.201 -0.454 . . . . 60.020000000000003 110.89 179.967 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 100.89 32.62 5.29 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.752 -0.737 . . . . 71.299999999999997 112.5 179.902 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 13.8 mm-40 -113.78 119.98 39.2 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.908 0.385 . . . . 73.099999999999994 110.896 -179.88 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . 0.466 ' O ' HD23 ' A' ' 116' ' ' LEU . 7.7 tptm -68.89 97.95 0.89 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.125 -0.488 . . . . 72.319999999999993 110.902 179.973 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.59 HD22 ' HG2' ' A' ' 120' ' ' GLU . 16.4 mt -133.01 119.41 20.03 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.244 -0.434 . . . . 73.219999999999999 110.896 179.929 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . 0.415 ' O ' HG23 ' A' ' 121' ' ' VAL . 82.2 p -84.22 174.31 10.3 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.183 -0.462 . . . . 62.32 111.126 179.966 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -52.68 -42.93 65.22 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.23 -0.441 . . . . 70.510000000000005 110.884 179.881 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -62.29 -33.39 74.56 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.194 -0.457 . . . . 63.340000000000003 110.862 -179.882 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . 0.59 ' HG2' HD22 ' A' ' 116' ' ' LEU . 6.2 tp10 -70.84 -39.42 72.97 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.151 -0.477 . . . . 74.010000000000005 110.867 -179.91 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.474 HG11 ' O ' ' A' ' 102' ' ' ALA . 21.9 t -65.25 -31.27 53.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.173 -0.467 . . . . 74.239999999999995 111.143 179.958 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 20.0 t0 -51.95 -46.11 64.62 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.133 -0.485 . . . . 73.430000000000007 110.905 179.919 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 13.3 tp10 -56.57 -29.6 62.21 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.198 -0.455 . . . . 73.400000000000006 110.878 -179.947 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . 0.65 ' HE2' HD21 ' A' ' 105' ' ' LEU . 55.7 mtp -75.42 -59.51 2.72 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.171 -0.468 . . . . 73.319999999999993 110.913 179.957 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.55 HG13 ' HB2' ' A' ' 102' ' ' ALA . 35.9 mm -53.95 -35.69 28.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.216 -0.447 . . . . 75.109999999999999 111.119 179.948 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 1.6 tmt_? -63.33 -31.9 73.17 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.137 -0.483 . . . . 75.420000000000002 110.904 179.939 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -74.8 -52.39 11.58 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.203 -0.453 . . . . 64.25 110.887 -179.947 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.652 ' HB3' HG22 ' A' ' 136' ' ' VAL . . . -65.13 -34.44 78.4 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.19 -0.459 . . . . 62.310000000000002 111.081 179.957 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 49.3 t0 -68.38 86.73 0.29 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.247 -0.433 . . . . 74.049999999999997 110.853 179.981 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 61.1 mt -79.86 -46.21 22.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.228 -0.442 . . . . 73.450000000000003 111.17 179.982 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 21.2 p30 -72.8 -8.67 56.6 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.173 -0.467 . . . . 73.530000000000001 110.862 179.815 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 62.81 43.05 99.52 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.751 -0.737 . . . . 63.109999999999999 112.488 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 34.5 p-10 -88.3 -15.93 34.43 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.847 0.356 . . . . 71.329999999999998 110.907 -179.991 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 103.91 2.45 45.81 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.701 -0.761 . . . . 42.25 112.491 -179.957 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 4.1 tt0 -149.19 172.26 15.11 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.816 0.341 . . . . 72.439999999999998 110.894 -179.862 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 136' ' ' VAL . . . . . 0.652 HG22 ' HB3' ' A' ' 128' ' ' ALA . 86.5 t -107.84 111.91 37.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.192 -0.458 . . . . 71.109999999999999 111.135 179.939 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 43.6 p-10 -92.52 166.61 12.43 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.183 -0.462 . . . . 65.430000000000007 110.908 179.97 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 138' ' ' TYR . . . . . 0.511 ' O ' HG23 ' A' ' 142' ' ' VAL . 52.1 t80 -51.98 -46.79 64.98 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.169 -0.469 . . . . 74.439999999999998 110.949 -179.948 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -52.01 -43.77 63.82 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.116 -0.493 . . . . 75.530000000000001 110.847 -179.947 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 24.1 mt-10 -75.11 -31.86 61.24 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.204 -0.453 . . . . 62.509999999999998 110.877 -179.911 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . 0.589 ' CD1' HG23 ' A' ' 85' ' ' ILE . 6.2 t80 -68.07 -35.35 78.06 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.114 -0.494 . . . . 75.409999999999997 110.902 -179.895 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . 0.596 HG22 HG21 ' A' ' 85' ' ' ILE . 92.7 t -71.23 -42.14 74.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.161 -0.472 . . . . 75.0 111.15 179.932 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 18.4 tt0 -71.07 -28.55 64.43 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.156 -0.475 . . . . 62.549999999999997 110.89 -179.993 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 6.2 tpt -74.0 -55.24 6.38 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.211 -0.449 . . . . 75.010000000000005 110.911 179.927 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 11.9 ttm -66.09 -33.87 76.77 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.219 -0.446 . . . . 75.310000000000002 110.912 179.927 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 2.0 m . . . . . 0 C--N 1.33 -0.278 0 CA-C-N 116.235 -0.439 . . . . 61.109999999999999 111.177 -179.961 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' M' M ' 15' ' ' LYS . . . . . . . . . . . . . 7.4 mtmp? . . . . . 0 C--O 1.231 0.098 0 CA-C-O 120.787 0.327 . . . . 71.299999999999997 110.881 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' M' M ' 16' ' ' TRP . . . . . 0.5 ' CE3' HD12 ' M' ' 19' ' ' ILE . 19.2 m95 -51.99 -38.95 58.53 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.184 -0.462 . . . . 71.530000000000001 110.978 179.917 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' M' M ' 17' ' ' GLU . . . . . . . . . . . . . 30.9 tp10 -56.17 -32.21 64.12 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.205 -0.452 . . . . 75.140000000000001 110.833 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' M' M ' 18' ' ' LYS . . . . . 0.608 ' HE2' HD13 ' A' ' 112' ' ' LEU . 6.4 ttpm? -63.36 -29.22 70.56 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.178 -0.464 . . . . 74.540000000000006 110.923 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' M' M ' 19' ' ' ILE . . . . . 0.5 HD12 ' CE3' ' M' ' 16' ' ' TRP . 28.8 mt -86.48 -25.13 6.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.192 -0.458 . . . . 53.509999999999998 111.166 179.86 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' M' M ' 20' ' ' ARG . . . . . . . . . . . . . 22.6 ttp180 . . . . . 0 C--N 1.33 -0.261 0 CA-C-N 116.17 -0.468 . . . . 75.150000000000006 110.863 179.984 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' M' M ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.146 0 CA-C-O 120.775 0.321 . . . . 74.510000000000005 110.889 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' M' M ' 31' ' ' LEU . . . . . 0.64 HD13 ' SD ' ' A' ' 51' ' ' MET . 13.7 tp -137.25 -51.39 0.65 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.196 -0.456 . . . . 53.210000000000001 110.911 179.924 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' M' M ' 32' ' ' LYS . . . . . . . . . . . . . 3.0 ptpp? -49.55 -39.14 33.74 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.219 -0.446 . . . . 72.540000000000006 110.901 179.81 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' M' M ' 33' ' ' HIS . . . . . . . . . . . . . 10.7 t-160 -50.09 -41.26 47.92 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.227 -0.442 . . . . 73.129999999999995 110.861 179.925 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' M' M ' 34' ' ' ILE . . . . . 0.444 HD12 HD12 ' M' ' 31' ' ' LEU . 65.0 mt -50.37 -39.32 16.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.19 -0.459 . . . . 63.32 111.148 179.989 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' M' M ' 35' ' ' VAL . . . . . 0.418 HG13 ' HB1' ' A' ' 15' ' ' ALA . 61.5 t -49.16 -40.28 13.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.192 -0.458 . . . . 73.549999999999997 111.121 179.824 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' M' M ' 36' ' ' TRP . . . . . . . . . . . . . 21.7 m0 -58.93 -39.52 81.83 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.122 -0.49 . . . . 74.420000000000002 110.927 179.985 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' M' M ' 37' ' ' ALA . . . . . 1.029 ' HB3' HD13 ' A' ' 39' ' ' LEU . . . -64.13 -18.61 64.59 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.218 -0.446 . . . . 34.210000000000001 111.117 179.869 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' M' M ' 38' ' ' SER . . . . . 0.627 ' HB3' HD23 ' A' ' 18' ' ' LEU . 0.8 OUTLIER -72.18 -17.98 61.9 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.237 -0.438 . . . . 74.150000000000006 110.872 -179.8 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' M' M ' 39' ' ' ARG . . . . . . . . . . . . . 4.6 tpt85 -60.75 -25.47 66.51 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.116 -0.493 . . . . 62.420000000000002 110.896 -179.914 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' M' M ' 40' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 -78.04 -47.99 17.12 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.131 -0.486 . . . . 62.210000000000001 110.874 -179.9 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' M' M ' 41' ' ' LEU . . . . . 0.688 HD11 ' OG ' ' A' ' 38' ' ' SER . 17.3 mt . . . . . 0 C--N 1.329 -0.309 0 CA-C-N 116.163 -0.471 . . . . 73.120000000000005 110.93 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 19.4 tt0 . . . . . 0 C--O 1.231 0.113 0 CA-C-O 120.772 0.32 . . . . 72.310000000000002 110.936 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 61.7 mt -68.78 -37.3 77.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.192 -0.458 . . . . 55.329999999999998 111.115 179.991 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -52.33 -49.85 63.45 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.166 -0.47 . . . . 55.210000000000001 111.082 179.852 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 17.0 mm-40 -54.92 -39.91 69.3 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.222 -0.445 . . . . 75.219999999999999 110.903 -179.916 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 31.4 m-85 -72.68 -41.2 65.59 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.148 -0.478 . . . . 72.209999999999994 110.852 -179.921 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 18.4 ttpp -54.81 -41.69 70.94 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.167 -0.47 . . . . 71.209999999999994 110.88 -179.99 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 8.4 tt0 -59.11 -36.12 74.63 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.228 -0.442 . . . . 70.439999999999998 110.884 179.948 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -67.91 -49.69 60.44 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.147 -0.478 . . . . 44.229999999999997 111.089 179.957 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 57.8 t80 -52.15 -49.52 63.59 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.226 -0.443 . . . . 74.140000000000001 110.913 -179.904 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 12.9 t -57.14 -30.39 64.39 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.151 -0.477 . . . . 63.130000000000003 110.893 -179.81 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.477 HD23 ' HB3' ' M' ' 38' ' ' SER . 15.7 tp -66.06 -42.2 89.78 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.068 -0.514 . . . . 74.140000000000001 110.885 179.984 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.613 ' HA ' HG21 ' A' ' 35' ' ' VAL . 67.6 m-85 -78.02 -24.92 47.72 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.222 -0.445 . . . . 74.310000000000002 110.866 179.94 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 14.3 t0 -79.14 98.61 6.63 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.178 -0.464 . . . . 75.430000000000007 110.866 179.975 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.448 ' NZ ' HG21 ' A' ' 34' ' ' THR . 9.2 ttmm -66.49 -50.28 63.79 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.201 -0.454 . . . . 63.32 110.895 179.995 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 18.5 p-10 -81.46 -10.09 59.57 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.219 -0.446 . . . . 71.030000000000001 110.831 179.908 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 52.04 55.64 20.38 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.73 -0.748 . . . . 24.039999999999999 112.508 -179.889 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 29.2 p-10 -111.56 17.74 19.73 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.798 0.332 . . . . 70.219999999999999 110.849 -179.968 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 71.68 18.25 77.17 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.753 -0.737 . . . . 43.109999999999999 112.529 -179.907 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 22.3 p -145.46 156.53 43.8 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.714 0.292 . . . . 73.510000000000005 111.155 -179.85 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.413 HG22 ' HB2' ' A' ' 32' ' ' LEU . 28.8 mt -130.27 125.47 59.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.233 -0.44 . . . . 74.030000000000001 111.193 179.924 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.6 HG22 HG21 ' A' ' 62' ' ' THR . 80.9 p -110.53 177.14 4.78 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.206 -0.452 . . . . 70.109999999999999 111.168 179.998 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 49.5 p -63.54 -25.47 68.26 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.22 -0.445 . . . . 74.430000000000007 111.115 -179.962 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 2.3 tppt? -79.96 -50.17 10.82 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.174 -0.466 . . . . 75.150000000000006 110.868 179.94 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 -67.89 -36.97 81.15 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.207 -0.451 . . . . 75.530000000000001 110.867 179.996 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.413 ' HB2' HG22 ' A' ' 27' ' ' ILE . 4.1 tt -73.83 -53.58 9.92 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.157 -0.474 . . . . 61.119999999999997 110.957 -179.973 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -51.92 -28.4 24.3 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.743 -0.741 . . . . 61.140000000000001 112.524 179.83 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.448 HG21 ' NZ ' ' A' ' 21' ' ' LYS . 97.6 m -63.18 -58.99 5.37 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.883 0.373 . . . . 64.219999999999999 111.172 -179.866 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.613 HG21 ' HA ' ' A' ' 19' ' ' PHE . 51.6 t -57.72 -34.57 48.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.173 -0.467 . . . . 72.310000000000002 111.141 179.891 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 6.3 mmm -59.62 -49.01 79.41 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.158 -0.474 . . . . 73.329999999999998 110.874 179.968 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 29.7 ttp180 -57.17 -42.65 81.52 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.236 -0.438 . . . . 75.420000000000002 110.872 -179.945 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . 0.419 ' OG ' HD21 ' M' ' 41' ' ' LEU . 1.6 t -57.91 -25.28 60.64 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.202 -0.454 . . . . 62.509999999999998 110.883 -179.814 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.891 HD13 ' HB3' ' M' ' 37' ' ' ALA . 83.3 mt -94.41 -10.39 32.64 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.084 -0.507 . . . . 70.439999999999998 110.876 -179.98 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 101.54 -6.63 55.4 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.76 -0.733 . . . . 44.32 112.468 179.93 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 15.8 tp60 -87.39 102.34 14.44 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.833 0.349 . . . . 75.099999999999994 110.9 -179.853 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 6.1 t-20 -109.85 76.75 0.98 Allowed Pre-proline 0 C--N 1.33 -0.279 0 CA-C-O 121.574 0.702 . . . . 65.340000000000003 110.887 -179.971 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.79 168.0 22.86 Favored 'Trans proline' 0 C--O 1.232 0.187 0 C-N-CA 122.709 2.273 . . . . 71.439999999999998 112.351 179.937 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 79.0 p -84.68 161.78 19.94 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.237 -0.438 . . . . 51.240000000000002 111.118 -179.949 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 94.1 mt-10 -52.41 -38.9 60.14 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.17 -0.468 . . . . 64.209999999999994 110.862 179.983 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.32 -39.28 65.39 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.183 -0.462 . . . . 42.530000000000001 111.051 179.957 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -62.09 -47.55 84.13 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.232 -0.44 . . . . 63.240000000000002 110.906 -179.923 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 22.0 mt -55.43 -47.48 75.91 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.159 -0.473 . . . . 71.310000000000002 110.894 -179.984 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 37.1 tp60 -71.86 -28.1 63.32 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.216 -0.447 . . . . 44.200000000000003 110.897 179.938 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -56.21 -49.77 73.14 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.218 -0.446 . . . . 63.329999999999998 110.888 179.904 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 6.0 ptp -69.85 -36.28 75.41 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.191 -0.459 . . . . 62.43 110.894 -179.986 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 87.3 mt -63.78 -41.35 92.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.249 -0.432 . . . . 73.310000000000002 111.153 179.922 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 34.5 m-20 -70.38 -31.7 69.05 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.18 -0.464 . . . . 73.230000000000004 110.907 179.935 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -71.62 -25.09 62.01 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.142 -0.481 . . . . 64.329999999999998 110.851 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.488 HG11 ' SD ' ' A' ' 71' ' ' MET . 29.1 m -106.65 7.2 9.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.196 -0.456 . . . . 52.32 111.119 179.98 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -82.62 99.77 9.77 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.192 -0.458 . . . . 73.209999999999994 110.843 179.961 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.4 -33.85 17.76 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.148 -0.478 . . . . 72.200000000000003 111.147 179.932 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 2.6 p-10 -92.52 -0.57 57.32 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.199 -0.455 . . . . 75.230000000000004 110.869 179.945 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 50.85 60.94 6.5 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.744 -0.741 . . . . 72.109999999999999 112.517 -179.899 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 50.9 p-10 -114.55 -15.78 11.97 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.915 0.388 . . . . 61.240000000000002 110.901 -179.873 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 95.43 15.71 42.87 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.726 -0.75 . . . . 62.340000000000003 112.503 179.963 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . 0.6 HG21 HG22 ' A' ' 28' ' ' THR . 22.5 p -152.68 175.45 12.81 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.795 0.331 . . . . 71.239999999999995 111.157 -179.922 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.57 HG21 ' HD1' ' A' ' 68' ' ' PHE . 27.0 mt -106.83 111.57 36.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.213 -0.449 . . . . 71.319999999999993 111.13 179.912 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -77.93 -172.78 2.83 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.158 -0.474 . . . . 72.019999999999996 110.856 179.89 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.538 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 2.4 t80 -64.93 -57.94 14.38 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.604 0.716 . . . . 73.140000000000001 110.9 -179.895 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . 0.538 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 53.8 Cg_endo -69.78 -28.74 24.76 Favored 'Trans proline' 0 C--N 1.341 0.159 0 C-N-CA 122.677 2.251 . . . . 73.430000000000007 112.353 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 18.2 mt-10 -60.97 -39.73 90.72 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.188 -0.46 . . . . 72.150000000000006 110.875 -179.984 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . 0.57 ' HD1' HG21 ' A' ' 63' ' ' ILE . 20.1 t80 -74.3 -36.23 63.72 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.094 -0.503 . . . . 75.329999999999998 110.848 -179.864 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 27.7 tp -69.53 -53.82 17.15 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.191 -0.459 . . . . 74.530000000000001 110.913 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 14.7 t -53.08 -27.95 22.74 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.193 -0.458 . . . . 61.229999999999997 111.134 179.934 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . 0.488 ' SD ' HG11 ' A' ' 55' ' ' VAL . 42.6 ttp -64.4 -49.9 69.72 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.27 -0.423 . . . . 63.450000000000003 110.856 179.914 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . 0.414 ' HE3' HG11 ' M' ' 35' ' ' VAL . 1.2 mtt -53.33 -44.15 68.24 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.244 -0.435 . . . . 52.32 110.849 179.998 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.301 0 CA-C-N 116.229 -0.441 . . . . 61.329999999999998 111.109 179.933 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.639 HG21 HG13 ' A' ' 142' ' ' VAL . 62.1 mt . . . . . 0 C--O 1.231 0.123 0 CA-C-O 120.784 0.326 . . . . 75.219999999999999 111.161 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 44.8 ttp85 -68.82 -52.25 32.07 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.164 -0.471 . . . . 73.439999999999998 110.845 179.977 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.733 ' O ' HG23 ' A' ' 91' ' ' VAL . 16.0 tp10 -54.54 -53.48 53.9 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.24 -0.436 . . . . 74.25 110.908 -179.937 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -53.36 -50.74 64.43 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.127 -0.488 . . . . 74.340000000000003 111.12 179.911 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 5.9 t80 -52.12 -51.28 58.84 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.22 -0.445 . . . . 74.329999999999998 110.899 -179.957 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 60.0 ttt-85 -59.93 -45.05 93.84 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.199 -0.455 . . . . 65.140000000000001 110.873 -179.93 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . 0.733 HG23 ' O ' ' A' ' 87' ' ' GLU . 91.6 t -53.94 -45.47 63.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.211 -0.45 . . . . 72.319999999999993 111.172 179.954 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 10.7 m-85 -76.39 -26.35 55.49 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.167 -0.47 . . . . 73.540000000000006 110.873 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 14.1 t0 -68.11 96.77 0.65 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.159 -0.473 . . . . 72.140000000000001 110.889 179.958 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 17.3 mmtt -75.16 -53.2 9.24 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.164 -0.471 . . . . 54.049999999999997 110.923 179.973 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 52.9 p30 -77.09 -9.07 58.49 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.215 -0.448 . . . . 73.349999999999994 110.808 179.919 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 59.6 26.51 62.42 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.74 -0.743 . . . . 71.5 112.459 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 37.8 p-10 -81.9 -16.12 51.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.878 0.37 . . . . 72.409999999999997 110.919 -179.905 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 90.08 18.76 49.21 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.773 -0.727 . . . . 42.409999999999997 112.483 179.927 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 15.0 m-85 -140.41 132.38 27.76 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.858 0.361 . . . . 72.129999999999995 110.917 -179.779 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 62.2 mt -101.2 135.04 39.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.138 -0.483 . . . . 70.5 111.151 179.902 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 89.5 p -117.1 -177.97 3.33 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.167 -0.469 . . . . 60.43 110.843 -179.881 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . 0.738 ' O ' HG11 ' A' ' 121' ' ' VAL . . . -70.32 -35.51 73.69 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.139 -0.482 . . . . 74.299999999999997 111.058 179.922 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -71.9 -35.28 69.66 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.246 -0.433 . . . . 43.240000000000002 111.104 179.931 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -76.88 -46.64 23.78 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.226 -0.443 . . . . 74.510000000000005 110.888 -179.909 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 19.0 tp -52.96 -48.01 67.72 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.175 -0.466 . . . . 72.430000000000007 110.893 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . 0.706 ' HB2' HG21 ' A' ' 121' ' ' VAL . 59.3 ttp85 -51.99 -40.04 60.31 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.199 -0.455 . . . . 64.420000000000002 110.858 179.975 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 13.5 t60 -55.85 -34.4 65.39 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.187 -0.46 . . . . 64.0 110.838 179.994 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 54.5 t -72.59 -52.03 25.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.235 -0.439 . . . . 75.209999999999994 111.122 -179.993 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 109' ' ' MET . . . . . 0.479 ' HB3' HD12 ' A' ' 116' ' ' LEU . 10.3 mmt -53.99 -28.12 35.91 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.153 -0.476 . . . . 72.409999999999997 110.874 179.908 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 4.0 m -66.9 -37.09 83.73 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.198 -0.455 . . . . 64.120000000000005 111.159 -179.907 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 43.0 t-20 -73.48 -26.12 60.76 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.212 -0.449 . . . . 55.399999999999999 110.904 179.975 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -70.69 -25.89 63.18 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.165 -0.47 . . . . 72.209999999999994 110.934 179.96 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 100.97 19.85 15.89 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.757 -0.735 . . . . 53.219999999999999 112.5 179.873 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -111.34 115.68 29.71 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.931 0.396 . . . . 74.0 110.892 -179.896 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . 0.584 ' O ' HD23 ' A' ' 116' ' ' LEU . 40.3 pttt -70.65 121.53 18.08 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.123 -0.489 . . . . 71.200000000000003 110.935 179.923 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.628 HD22 ' HG2' ' A' ' 120' ' ' GLU . 11.3 mt -143.33 161.0 39.49 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.235 -0.439 . . . . 63.329999999999998 110.935 179.947 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 67.9 p -118.59 174.33 6.33 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.205 -0.452 . . . . 63.100000000000001 111.089 179.993 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 47.8 m-20 -52.04 -48.35 64.63 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.182 -0.463 . . . . 64.430000000000007 110.865 179.9 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -60.67 -33.44 72.83 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.166 -0.47 . . . . 73.319999999999993 110.945 -179.929 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . 0.628 ' HG2' HD22 ' A' ' 116' ' ' LEU . 1.1 tp10 -68.97 -44.81 72.17 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.133 -0.485 . . . . 71.140000000000001 110.904 -179.979 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.738 HG11 ' O ' ' A' ' 102' ' ' ALA . 63.3 t -58.04 -33.32 46.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.174 -0.466 . . . . 71.230000000000004 111.106 179.963 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -51.97 -43.76 63.7 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.229 -0.441 . . . . 43.43 110.863 179.934 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 22.9 tp10 -56.33 -31.52 63.8 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.202 -0.454 . . . . 74.430000000000007 110.916 -179.928 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . 0.403 ' HE3' ' HB3' ' M' ' 15' ' ' LYS . 80.0 mtp -76.03 -59.5 2.73 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.16 -0.473 . . . . 74.209999999999994 110.891 179.938 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 34.8 mm -53.99 -35.74 29.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.198 -0.455 . . . . 71.349999999999994 111.097 179.992 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 9.6 tpt180 -65.43 -31.76 73.02 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.187 -0.46 . . . . 75.129999999999995 110.842 179.991 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -71.97 -49.71 35.0 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.202 -0.454 . . . . 53.229999999999997 110.852 -179.908 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.563 ' HB3' HG22 ' A' ' 136' ' ' VAL . . . -70.39 -33.66 71.66 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.208 -0.451 . . . . 60.509999999999998 111.087 179.936 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 50.7 t0 -68.41 86.63 0.29 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.21 -0.45 . . . . 71.299999999999997 110.835 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 130' ' ' ILE . . . . . 0.437 HD11 HE21 ' A' ' 143' ' ' GLN . 59.1 mt -79.98 -45.33 22.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.18 -0.464 . . . . 73.200000000000003 111.148 179.962 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 23.1 p30 -72.69 -8.82 57.24 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.168 -0.469 . . . . 61.020000000000003 110.833 179.866 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 62.8 43.76 98.47 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.725 -0.75 . . . . 31.329999999999998 112.481 -179.925 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 32.5 p-10 -89.33 -16.05 31.99 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.868 0.365 . . . . 64.319999999999993 110.882 -179.961 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 102.66 3.37 49.74 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.724 -0.75 . . . . 63.340000000000003 112.478 -179.964 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 3.8 tt0 -149.26 172.22 15.23 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.816 0.341 . . . . 74.140000000000001 110.923 -179.87 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 136' ' ' VAL . . . . . 0.563 HG22 ' HB3' ' A' ' 128' ' ' ALA . 98.9 t -113.18 114.87 48.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.248 -0.433 . . . . 73.420000000000002 111.192 179.94 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 41.9 p-10 -93.28 167.87 11.46 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.174 -0.466 . . . . 74.109999999999999 110.928 -179.975 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 138' ' ' TYR . . . . . 0.652 ' O ' HG23 ' A' ' 142' ' ' VAL . 14.1 t80 -51.96 -43.65 63.61 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.218 -0.446 . . . . 72.519999999999996 110.971 -179.931 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -55.74 -55.14 35.79 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.148 -0.478 . . . . 52.109999999999999 110.881 179.96 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 88.8 mt-10 -62.08 -45.42 93.58 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.172 -0.467 . . . . 65.319999999999993 110.9 -179.941 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 69.4 t80 -54.88 -54.94 36.03 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.129 -0.487 . . . . 73.450000000000003 110.903 -179.914 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . 0.652 HG23 ' O ' ' A' ' 138' ' ' TYR . 96.8 t -53.86 -43.35 56.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.13 -0.486 . . . . 55.409999999999997 111.172 179.91 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . 0.437 HE21 HD11 ' A' ' 130' ' ' ILE . 1.1 tm0? -64.23 -58.42 6.62 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.155 -0.475 . . . . 71.25 110.934 179.978 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 11.3 tpt -57.5 -24.83 58.17 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.235 -0.439 . . . . 71.219999999999999 110.909 179.927 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 145' ' ' MET . . . . . 0.474 ' HE1' HG22 ' M' ' 19' ' ' ILE . 0.3 OUTLIER -86.75 -24.14 25.21 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.2 -0.455 . . . . 73.439999999999998 110.898 179.932 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 97.3 m . . . . . 0 C--N 1.33 -0.262 0 CA-C-N 116.234 -0.439 . . . . 71.010000000000005 111.119 -179.934 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' M' M ' 15' ' ' LYS . . . . . 0.403 ' HB3' ' HE3' ' A' ' 124' ' ' MET . 7.2 mttp . . . . . 0 C--O 1.232 0.135 0 CA-C-O 120.768 0.318 . . . . 72.450000000000003 110.895 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' M' M ' 16' ' ' TRP . . . . . . . . . . . . . 67.2 m95 -52.82 -41.46 64.23 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.216 -0.447 . . . . 74.510000000000005 110.893 179.909 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' M' M ' 17' ' ' GLU . . . . . . . . . . . . . 15.4 tm-20 -57.4 -30.2 64.74 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.241 -0.436 . . . . 71.530000000000001 110.893 -179.929 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' M' M ' 18' ' ' LYS . . . . . . . . . . . . . 15.5 tttp -62.91 -28.03 69.78 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.176 -0.465 . . . . 74.329999999999998 110.875 179.946 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' M' M ' 19' ' ' ILE . . . . . 0.474 HG22 ' HE1' ' A' ' 145' ' ' MET . 22.7 mt -98.66 -23.83 4.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.267 -0.424 . . . . 72.129999999999995 111.156 179.868 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' M' M ' 20' ' ' ARG . . . . . . . . . . . . . 30.6 ttt-85 . . . . . 0 C--N 1.329 -0.285 0 CA-C-N 116.185 -0.461 . . . . 75.409999999999997 110.836 -179.971 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' M' M ' 30' ' ' LYS . . . . . . . . . . . . . 2.1 pttp . . . . . 0 C--O 1.232 0.135 0 CA-C-O 120.776 0.322 . . . . 75.030000000000001 110.857 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' M' M ' 31' ' ' LEU . . . . . 0.593 ' HA ' HD12 ' M' ' 34' ' ' ILE . 7.2 tp -124.33 -48.78 1.82 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.228 -0.442 . . . . 71.25 110.918 179.935 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' M' M ' 32' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -47.21 -40.15 15.62 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.212 -0.449 . . . . 71.209999999999994 110.937 179.809 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' M' M ' 33' ' ' HIS . . . . . . . . . . . . . 79.9 t60 -48.12 -46.35 34.04 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.148 -0.478 . . . . 74.209999999999994 110.865 179.913 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' M' M ' 34' ' ' ILE . . . . . 0.593 HD12 ' HA ' ' M' ' 31' ' ' LEU . 3.3 mt -51.77 -38.57 22.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.214 -0.448 . . . . 72.239999999999995 111.096 179.996 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' M' M ' 35' ' ' VAL . . . . . 0.414 HG11 ' HE3' ' A' ' 72' ' ' MET . 48.5 t -50.1 -38.9 15.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.18 -0.464 . . . . 45.350000000000001 111.107 179.886 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' M' M ' 36' ' ' TRP . . . . . . . . . . . . . 26.6 m0 -59.29 -39.03 81.67 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.188 -0.46 . . . . 73.209999999999994 110.914 179.954 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' M' M ' 37' ' ' ALA . . . . . 0.891 ' HB3' HD13 ' A' ' 39' ' ' LEU . . . -63.94 -18.39 64.2 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.225 -0.443 . . . . 70.140000000000001 111.095 179.911 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' M' M ' 38' ' ' SER . . . . . 0.477 ' HB3' HD23 ' A' ' 18' ' ' LEU . 2.5 m -71.07 -17.94 62.58 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.243 -0.435 . . . . 50.340000000000003 110.857 -179.803 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' M' M ' 39' ' ' ARG . . . . . . . . . . . . . 14.9 mmm180 -52.07 -29.96 23.71 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.151 -0.477 . . . . 73.409999999999997 110.849 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' M' M ' 40' ' ' GLU . . . . . . . . . . . . . 9.4 tt0 -92.37 -40.71 10.74 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.21 -0.45 . . . . 64.439999999999998 110.915 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' M' M ' 41' ' ' LEU . . . . . 0.419 HD21 ' OG ' ' A' ' 38' ' ' SER . 5.0 mt . . . . . 0 C--N 1.328 -0.329 0 CA-C-N 116.162 -0.472 . . . . 62.130000000000003 110.931 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 1.6 tp-100 . . . . . 0 C--O 1.232 0.138 0 CA-C-O 120.734 0.302 . . . . 72.140000000000001 110.904 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 62.0 mt -67.04 -37.14 78.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.212 -0.449 . . . . 55.100000000000001 111.124 179.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -51.95 -49.9 62.27 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.191 -0.459 . . . . 63.539999999999999 111.098 179.815 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 25.3 mm-40 -54.87 -52.24 63.45 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.179 -0.464 . . . . 74.420000000000002 110.931 -179.966 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 66.0 m-85 -60.04 -44.17 94.83 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.123 -0.489 . . . . 73.430000000000007 110.933 -179.953 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 38.0 ttmt -51.98 -33.5 38.26 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.088 -0.505 . . . . 63.100000000000001 110.866 -179.996 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -68.74 -36.65 78.66 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.234 -0.439 . . . . 71.109999999999999 110.904 179.975 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -66.52 -52.28 47.52 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.14 -0.482 . . . . 40.020000000000003 111.076 179.931 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 42.4 t80 -52.6 -47.44 66.94 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.19 -0.459 . . . . 63.439999999999998 110.859 -179.898 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.6 m -59.48 -28.98 67.5 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.156 -0.475 . . . . 53.509999999999998 110.885 -179.793 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.65 HD23 ' HB3' ' M' ' 38' ' ' SER . 15.3 tp -68.59 -47.54 66.48 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.111 -0.495 . . . . 75.400000000000006 110.897 -179.995 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 62.1 m-85 -71.67 -26.09 62.39 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.178 -0.465 . . . . 61.020000000000003 110.89 179.928 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 18.6 t0 -86.33 98.47 10.99 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.154 -0.475 . . . . 71.420000000000002 110.845 -179.996 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 39.6 mtpt -71.86 -53.12 14.21 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.216 -0.447 . . . . 74.209999999999994 110.862 -179.977 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 26.3 p-10 -73.5 -10.11 59.39 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.244 -0.435 . . . . 73.439999999999998 110.802 179.912 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 52.03 46.45 55.88 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.792 -0.718 . . . . 52.450000000000003 112.451 -179.946 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 26.7 p-10 -88.46 -15.73 34.62 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.891 0.377 . . . . 71.5 110.906 179.993 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 105.32 -11.73 47.65 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.696 -0.764 . . . . 65.030000000000001 112.508 -179.902 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 51.6 p -131.31 130.71 43.09 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.755 0.312 . . . . 72.230000000000004 111.157 -179.886 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 29.8 mt -90.72 135.82 25.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.206 -0.452 . . . . 65.340000000000003 111.138 179.898 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.672 HG22 HG22 ' A' ' 62' ' ' THR . 15.0 p -115.97 -179.37 3.64 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.195 -0.457 . . . . 61.039999999999999 111.176 179.936 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.685 HG23 HD12 ' A' ' 52' ' ' ILE . 8.2 p -68.69 -33.02 73.25 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.227 -0.442 . . . . 73.25 111.167 -179.988 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 14.8 ptpt -69.6 -41.42 75.75 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.194 -0.457 . . . . 75.319999999999993 110.889 179.878 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.491 ' O ' HG23 ' A' ' 35' ' ' VAL . 62.1 mt-10 -75.9 -35.4 59.83 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.22 -0.445 . . . . 75.340000000000003 110.924 179.968 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.1 tt -74.31 -53.78 9.01 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.136 -0.484 . . . . 75.549999999999997 110.904 -179.962 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -52.1 -43.28 56.08 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.801 -0.714 . . . . 65.409999999999997 112.488 179.904 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 96.0 m -56.97 -55.07 39.45 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.816 0.341 . . . . 75.299999999999997 111.146 -179.896 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.491 HG23 ' O ' ' A' ' 31' ' ' GLU . 100.0 t -51.67 -50.22 31.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.21 -0.45 . . . . 65.129999999999995 111.096 179.937 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 7.5 mtp -51.97 -39.07 58.77 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.16 -0.473 . . . . 61.310000000000002 110.905 179.932 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 30.1 ttt85 -54.11 -40.15 67.04 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.179 -0.464 . . . . 63.5 110.837 -179.9 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . 0.611 ' OG ' HD21 ' M' ' 41' ' ' LEU . 3.8 t -76.8 -28.39 55.59 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.179 -0.464 . . . . 60.43 110.904 -179.809 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 1.009 HD13 ' HB3' ' M' ' 37' ' ' ALA . 58.6 mt -76.98 -21.49 54.63 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.127 -0.488 . . . . 72.510000000000005 110.909 179.986 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 101.45 31.11 5.65 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.753 -0.737 . . . . 73.319999999999993 112.476 179.858 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 2.2 tp-100 -116.96 140.32 49.61 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.842 0.353 . . . . 75.209999999999994 110.856 -179.85 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 29.8 t30 -109.87 76.8 0.99 Allowed Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.63 0.729 . . . . 72.120000000000005 110.913 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.75 140.0 41.64 Favored 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.71 2.274 . . . . 60.020000000000003 112.311 179.951 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 19.9 p -97.29 158.35 15.5 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.2 -0.454 . . . . 74.540000000000006 111.157 -179.986 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -51.94 -43.41 63.46 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.225 -0.443 . . . . 75.420000000000002 110.914 179.966 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.36 -32.93 64.81 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.18 -0.463 . . . . 65.319999999999993 111.088 179.937 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 11.0 tt0 -67.57 -50.77 56.85 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.194 -0.457 . . . . 55.439999999999998 110.89 -179.936 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.66 ' HB3' HG22 ' A' ' 29' ' ' THR . 45.9 mt -55.05 -51.85 65.02 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.172 -0.467 . . . . 70.200000000000003 110.951 179.984 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 29.8 tp60 -57.24 -29.07 63.47 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.148 -0.478 . . . . 65.329999999999998 110.94 179.89 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -72.17 -37.6 69.3 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.208 -0.451 . . . . 72.099999999999994 110.881 179.964 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . 0.49 ' O ' HG22 ' A' ' 55' ' ' VAL . 5.7 mtp -63.7 -57.89 8.59 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.172 -0.467 . . . . 73.329999999999998 110.858 179.985 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.685 HD12 HG23 ' A' ' 29' ' ' THR . 62.4 mt -54.89 -45.27 75.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.243 -0.435 . . . . 74.409999999999997 111.143 179.972 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 76.8 m-20 -66.32 -33.84 76.63 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.183 -0.462 . . . . 71.329999999999998 110.884 179.921 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -63.12 -30.56 71.68 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.212 -0.449 . . . . 75.010000000000005 110.861 -179.965 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.49 HG22 ' O ' ' A' ' 51' ' ' MET . 4.8 m -111.12 18.98 7.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.162 -0.472 . . . . 73.150000000000006 111.095 -179.987 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 31.5 t0 -89.99 93.06 9.25 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.205 -0.452 . . . . 63.109999999999999 110.889 179.893 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.16 -33.71 18.1 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.249 -0.432 . . . . 71.150000000000006 111.079 179.962 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 14.7 p30 -91.35 -0.15 57.61 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.226 -0.443 . . . . 35.520000000000003 110.868 179.962 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 52.35 59.54 8.86 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.726 -0.75 . . . . 70.409999999999997 112.496 -179.899 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 51.5 p-10 -114.48 -15.73 12.01 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.833 0.349 . . . . 70.230000000000004 110.919 -179.926 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 89.77 18.46 51.32 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.715 -0.755 . . . . 72.230000000000004 112.505 179.966 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . 0.672 HG22 HG22 ' A' ' 28' ' ' THR . 22.5 p -152.65 159.37 43.2 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.788 0.328 . . . . 54.32 111.167 -179.914 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.465 HG21 ' HD1' ' A' ' 68' ' ' PHE . 25.1 mt -91.94 109.48 21.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.215 -0.448 . . . . 75.400000000000006 111.137 179.907 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.4 t0 -73.82 -176.42 2.43 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.152 -0.476 . . . . 70.510000000000005 110.867 179.875 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.534 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 2.5 t80 -62.85 -58.32 17.19 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-O 121.652 0.739 . . . . 72.299999999999997 110.914 -179.887 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . 0.534 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 53.7 Cg_endo -69.81 -30.02 22.7 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.697 2.264 . . . . 52.130000000000003 112.344 179.982 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 -57.24 -41.47 79.6 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.205 -0.452 . . . . 72.129999999999995 110.918 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . 0.465 ' HD1' HG21 ' A' ' 63' ' ' ILE . 24.2 t80 -74.14 -36.1 64.12 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.106 -0.497 . . . . 75.400000000000006 110.886 -179.971 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 28.9 tp -65.48 -53.65 39.5 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.155 -0.475 . . . . 72.140000000000001 110.887 -179.937 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 11.2 t -54.02 -26.69 27.61 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.247 -0.433 . . . . 74.439999999999998 111.129 179.967 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . 0.411 ' SD ' HD23 ' M' ' 31' ' ' LEU . 42.9 ttp -70.67 -35.46 72.85 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.208 -0.451 . . . . 73.430000000000007 110.89 179.937 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 11.1 mtp -77.69 -33.72 53.14 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.213 -0.449 . . . . 73.239999999999995 110.888 179.938 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.284 0 CA-C-N 116.227 -0.442 . . . . 54.310000000000002 111.059 179.958 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.562 HG23 ' HE1' ' A' ' 141' ' ' PHE . 54.8 mt . . . . . 0 N--CA 1.458 -0.068 0 CA-C-O 120.835 0.35 . . . . 71.420000000000002 111.133 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.16 -30.3 26.15 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.104 -0.498 . . . . 73.109999999999999 110.882 179.988 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.411 ' O ' HG23 ' A' ' 91' ' ' VAL . 11.1 tt0 -76.41 -56.95 4.16 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.211 -0.449 . . . . 74.299999999999997 110.866 -179.953 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . 0.503 ' HB1' ' CE2' ' A' ' 92' ' ' PHE . . . -54.82 -43.23 72.78 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.141 -0.482 . . . . 73.5 111.089 179.962 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 8.8 t80 -52.02 -51.19 59.01 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.226 -0.443 . . . . 75.209999999999994 110.892 -179.953 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 50.3 ttt-85 -58.84 -44.89 91.07 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.124 -0.489 . . . . 73.239999999999995 110.902 -179.939 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . 0.411 HG23 ' O ' ' A' ' 87' ' ' GLU . 57.6 t -54.67 -49.36 68.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.178 -0.465 . . . . 63.240000000000002 111.185 179.938 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.503 ' CE2' ' HB1' ' A' ' 88' ' ' ALA . 8.9 m-85 -70.92 -32.36 69.26 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.149 -0.478 . . . . 72.150000000000006 110.889 179.986 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 16.6 t0 -61.71 96.72 0.07 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.175 -0.466 . . . . 75.209999999999994 110.822 179.983 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 58.2 mmtt -76.24 -53.17 8.64 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.175 -0.466 . . . . 60.020000000000003 110.876 179.993 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 56.0 p-10 -76.02 -9.17 58.4 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.216 -0.447 . . . . 72.439999999999998 110.872 179.868 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 59.64 26.87 63.03 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.733 -0.746 . . . . 24.43 112.45 -179.96 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 42.4 p-10 -81.77 -16.17 51.87 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.863 0.363 . . . . 75.099999999999994 110.908 -179.956 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 91.89 18.75 42.63 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.748 -0.739 . . . . 73.209999999999994 112.494 -179.998 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 6.2 m-85 -136.42 159.32 42.12 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.855 0.36 . . . . 72.019999999999996 110.907 -179.802 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 62.8 mt -122.4 123.95 69.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.143 -0.48 . . . . 65.409999999999997 111.127 179.93 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 63.2 p -107.17 -172.58 2.11 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.175 -0.466 . . . . 54.119999999999997 110.835 -179.913 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . 0.675 ' O ' HG11 ' A' ' 121' ' ' VAL . . . -73.96 -36.6 64.6 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.112 -0.494 . . . . 55.030000000000001 111.056 179.935 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -72.0 -31.37 66.16 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.228 -0.442 . . . . 73.510000000000005 111.11 179.983 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -74.9 -48.69 23.39 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.163 -0.471 . . . . 71.530000000000001 110.882 -179.924 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 22.1 tp -54.02 -47.89 71.05 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.162 -0.472 . . . . 74.219999999999999 110.937 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . 0.56 ' O ' HG23 ' A' ' 110' ' ' THR . 42.2 ttp85 -52.37 -44.53 65.33 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.182 -0.463 . . . . 71.450000000000003 110.904 179.911 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 11.1 t60 -58.45 -34.53 70.94 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.202 -0.453 . . . . 74.030000000000001 110.832 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 92.7 t -67.04 -52.2 46.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.201 -0.454 . . . . 71.209999999999994 111.175 179.948 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 109' ' ' MET . . . . . 0.421 ' HA ' HD12 ' A' ' 112' ' ' LEU . 4.2 mmt -64.2 -46.07 85.5 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.139 -0.482 . . . . 61.329999999999998 110.85 179.905 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . 0.56 HG23 ' O ' ' A' ' 106' ' ' ARG . 41.8 p -51.88 -37.16 51.18 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.24 -0.436 . . . . 61.32 111.174 -179.933 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 43.8 t30 -57.86 -33.7 68.96 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.211 -0.45 . . . . 72.340000000000003 110.916 179.953 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.699 HD13 ' HE3' ' M' ' 18' ' ' LYS . 15.3 mt -70.7 -23.9 62.55 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.151 -0.477 . . . . 72.400000000000006 110.908 179.943 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 101.06 32.93 5.13 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.714 -0.755 . . . . 74.319999999999993 112.428 179.883 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -110.07 116.27 31.26 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.92 0.391 . . . . 74.239999999999995 110.898 -179.918 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 29.3 tttm -60.73 120.29 9.79 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.153 -0.476 . . . . 73.310000000000002 110.931 179.96 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.452 HD22 ' HG2' ' A' ' 120' ' ' GLU . 19.8 mt -145.88 155.42 42.87 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.246 -0.434 . . . . 71.040000000000006 110.897 179.92 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 41.0 p -118.73 169.03 10.18 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.168 -0.469 . . . . 72.420000000000002 111.177 179.943 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 41.2 m-20 -53.07 -46.08 68.43 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.268 -0.424 . . . . 72.420000000000002 110.897 179.887 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 17.9 tt0 -63.54 -34.23 77.35 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.188 -0.46 . . . . 71.329999999999998 110.867 -179.921 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . 0.452 ' HG2' HD22 ' A' ' 116' ' ' LEU . 2.3 tp10 -67.23 -32.65 73.84 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.186 -0.461 . . . . 64.329999999999998 110.871 -179.902 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.675 HG11 ' O ' ' A' ' 102' ' ' ALA . 92.8 t -69.48 -32.67 53.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.154 -0.475 . . . . 62.310000000000002 111.137 179.971 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 10.8 t0 -51.95 -46.92 64.92 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.18 -0.464 . . . . 63.32 110.878 179.948 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -55.74 -29.3 59.32 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.131 -0.486 . . . . 72.5 110.873 -179.898 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 1.2 mtp -75.37 -59.74 2.61 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.155 -0.475 . . . . 65.209999999999994 110.866 -179.997 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 35.5 mm -54.13 -35.61 29.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.215 -0.448 . . . . 71.329999999999998 111.11 179.977 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 51.2 ttt180 -63.03 -31.78 72.99 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.174 -0.466 . . . . 74.510000000000005 110.893 179.957 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 9.7 tt0 -75.33 -52.48 10.71 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.183 -0.462 . . . . 71.319999999999993 110.883 -179.893 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.528 ' HB3' ' CG2' ' A' ' 136' ' ' VAL . . . -64.92 -33.87 77.07 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.117 -0.492 . . . . 52.439999999999998 111.071 179.959 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 49.5 t0 -68.73 86.31 0.32 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.238 -0.437 . . . . 73.329999999999998 110.882 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 130' ' ' ILE . . . . . 0.694 HD12 ' HG2' ' A' ' 140' ' ' GLU . 4.0 mt -79.91 -45.72 22.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.229 -0.442 . . . . 75.019999999999996 111.128 -179.952 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 22.0 p30 -72.77 -8.8 57.18 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.184 -0.462 . . . . 73.409999999999997 110.88 179.823 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 62.86 44.41 97.48 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.73 -0.748 . . . . 55.539999999999999 112.518 -179.891 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 31.8 p-10 -90.44 -15.95 29.92 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.841 0.353 . . . . 75.239999999999995 110.882 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 101.97 3.77 51.62 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.726 -0.75 . . . . 75.209999999999994 112.518 -179.906 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 4.4 tt0 -149.29 172.31 15.09 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.873 0.368 . . . . 75.409999999999997 110.91 -179.857 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 136' ' ' VAL . . . . . 0.528 ' CG2' ' HB3' ' A' ' 128' ' ' ALA . 66.9 t -114.78 111.09 34.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.187 -0.461 . . . . 53.149999999999999 111.166 179.964 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 45.4 p-10 -93.67 171.66 8.75 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.17 -0.468 . . . . 70.400000000000006 110.915 -179.986 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 138' ' ' TYR . . . . . 0.701 ' O ' HG23 ' A' ' 142' ' ' VAL . 86.9 t80 -56.18 -46.83 79.21 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.232 -0.44 . . . . 72.420000000000002 110.901 -179.901 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 22.1 tt0 -52.11 -44.56 64.51 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.097 -0.501 . . . . 63.030000000000001 110.914 -179.981 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 140' ' ' GLU . . . . . 0.694 ' HG2' HD12 ' A' ' 130' ' ' ILE . 94.9 mt-10 -73.94 -40.26 63.2 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.166 -0.47 . . . . 62.509999999999998 110.87 -179.929 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . 0.562 ' HE1' HG23 ' A' ' 85' ' ' ILE . 42.7 t80 -60.47 -41.34 93.97 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.176 -0.465 . . . . 72.010000000000005 110.884 -179.936 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . 0.701 HG23 ' O ' ' A' ' 138' ' ' TYR . 99.7 t -60.19 -49.46 84.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.165 -0.47 . . . . 72.239999999999995 111.162 179.963 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . 0.548 ' HA ' HG22 ' A' ' 146' ' ' THR . 29.7 tt0 -72.28 -23.47 61.19 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.191 -0.459 . . . . 75.200000000000003 110.911 179.994 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 10.8 tpt -74.99 -18.79 60.31 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.241 -0.436 . . . . 72.310000000000002 110.872 179.958 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 9.2 ttm -98.22 -32.93 11.31 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.214 -0.448 . . . . 74.099999999999994 110.894 179.94 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 146' ' ' THR . . . . . 0.548 HG22 ' HA ' ' A' ' 143' ' ' GLN . 5.0 t . . . . . 0 C--N 1.329 -0.309 0 CA-C-N 116.243 -0.435 . . . . 43.149999999999999 111.11 -179.91 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' M' M ' 15' ' ' LYS . . . . . . . . . . . . . 3.0 mttp . . . . . 0 C--O 1.23 0.075 0 CA-C-O 120.729 0.299 . . . . 54.340000000000003 110.901 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' M' M ' 16' ' ' TRP . . . . . . . . . . . . . 73.9 m95 -50.85 -32.74 21.26 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.199 -0.455 . . . . 71.230000000000004 110.929 179.918 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' M' M ' 17' ' ' GLU . . . . . . . . . . . . . 59.1 tt0 -54.08 -34.54 60.41 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.218 -0.447 . . . . 73.319999999999993 110.914 179.998 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' M' M ' 18' ' ' LYS . . . . . 0.699 ' HE3' HD13 ' A' ' 112' ' ' LEU . 23.4 tttp -65.16 -28.55 69.48 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.152 -0.476 . . . . 71.420000000000002 110.908 179.953 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' M' M ' 19' ' ' ILE . . . . . . . . . . . . . 28.6 mt -90.7 -29.98 4.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.214 -0.448 . . . . 64.219999999999999 111.157 179.879 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' M' M ' 20' ' ' ARG . . . . . . . . . . . . . 39.0 ttp85 . . . . . 0 C--N 1.329 -0.283 0 CA-C-N 116.147 -0.479 . . . . 75.430000000000007 110.87 179.928 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' M' M ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.133 0 CA-C-O 120.815 0.34 . . . . 53.420000000000002 110.891 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' M' M ' 31' ' ' LEU . . . . . 0.896 HD12 HD12 ' M' ' 34' ' ' ILE . 14.8 tp -124.39 -41.44 2.17 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.262 -0.426 . . . . 70.420000000000002 110.926 179.935 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' M' M ' 32' ' ' LYS . . . . . . . . . . . . . 42.6 tttt -49.57 -42.87 45.49 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.178 -0.465 . . . . 53.140000000000001 110.909 179.827 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' M' M ' 33' ' ' HIS . . . . . . . . . . . . . 80.7 t60 -50.33 -39.19 45.27 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.185 -0.461 . . . . 73.540000000000006 110.851 179.912 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' M' M ' 34' ' ' ILE . . . . . 0.896 HD12 HD12 ' M' ' 31' ' ' LEU . 62.3 mt -50.7 -39.46 18.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.204 -0.453 . . . . 70.219999999999999 111.138 179.987 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' M' M ' 35' ' ' VAL . . . . . . . . . . . . . 98.9 t -49.8 -39.22 14.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.129 -0.487 . . . . 74.319999999999993 111.158 179.863 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' M' M ' 36' ' ' TRP . . . . . . . . . . . . . 29.9 m0 -58.85 -39.16 80.48 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.139 -0.482 . . . . 73.540000000000006 110.933 179.965 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' M' M ' 37' ' ' ALA . . . . . 1.009 ' HB3' HD13 ' A' ' 39' ' ' LEU . . . -63.9 -18.59 64.36 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.216 -0.447 . . . . 62.340000000000003 111.117 179.88 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' M' M ' 38' ' ' SER . . . . . 0.65 ' HB3' HD23 ' A' ' 18' ' ' LEU . 0.7 OUTLIER -73.94 -17.9 60.96 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.185 -0.461 . . . . 30.329999999999998 110.848 -179.742 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' M' M ' 39' ' ' ARG . . . . . . . . . . . . . 50.7 mtp180 -55.55 -31.4 62.11 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.131 -0.486 . . . . 72.129999999999995 110.85 -179.944 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' M' M ' 40' ' ' GLU . . . . . . . . . . . . . 14.3 tp10 -79.94 -46.53 16.55 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.156 -0.474 . . . . 73.519999999999996 110.89 -179.934 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' M' M ' 41' ' ' LEU . . . . . 0.611 HD21 ' OG ' ' A' ' 38' ' ' SER . 11.9 mt . . . . . 0 C--N 1.328 -0.35 0 CA-C-N 116.14 -0.482 . . . . 72.409999999999997 110.89 -179.936 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 8.5 tp-100 . . . . . 0 C--O 1.232 0.139 0 CA-C-O 120.79 0.329 . . . . 72.109999999999999 110.942 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 59.2 mt -70.5 -43.33 78.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.238 -0.437 . . . . 65.239999999999995 111.116 179.932 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -52.11 -29.62 22.54 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.21 -0.45 . . . . 55.549999999999997 111.078 179.847 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 43.7 mm-40 -74.66 -52.0 12.84 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.28 -0.418 . . . . 73.129999999999995 110.882 -179.952 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 24.2 m-85 -61.91 -46.04 91.08 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.153 -0.476 . . . . 75.310000000000002 110.845 -179.88 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 34.1 ttmt -55.33 -26.98 44.07 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.117 -0.492 . . . . 72.230000000000004 110.95 179.962 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 56.4 tt0 -72.61 -38.72 67.72 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.222 -0.445 . . . . 74.420000000000002 110.888 179.927 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -63.77 -43.4 96.5 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.181 -0.463 . . . . 73.5 111.103 179.942 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 67.1 t80 -57.12 -53.7 55.06 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.197 -0.456 . . . . 63.140000000000001 110.904 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 46.9 m -52.35 -34.24 46.53 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.133 -0.485 . . . . 74.129999999999995 110.871 -179.795 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.64 HD23 ' HB3' ' M' ' 38' ' ' SER . 16.6 tp -62.43 -46.68 87.46 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.09 -0.505 . . . . 70.230000000000004 110.913 179.996 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.491 ' CE1' HG11 ' A' ' 35' ' ' VAL . 46.2 m-85 -71.95 -25.98 62.1 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.2 -0.454 . . . . 44.310000000000002 110.877 179.933 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 13.9 t0 -82.69 98.54 9.11 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.138 -0.483 . . . . 72.310000000000002 110.852 179.995 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 15.8 ttmm -67.88 -51.76 44.37 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.168 -0.469 . . . . 63.039999999999999 110.863 -179.989 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 29.9 p-10 -79.57 -10.1 59.74 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.217 -0.447 . . . . 63.350000000000001 110.884 179.925 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 51.96 44.32 55.99 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.764 -0.732 . . . . 51.399999999999999 112.454 -179.938 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 17.2 p-10 -88.5 -15.72 34.55 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.813 0.339 . . . . 74.140000000000001 110.851 -179.989 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 102.24 17.09 21.19 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.716 -0.754 . . . . 64.109999999999999 112.521 -179.919 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -154.58 131.43 10.81 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.76 0.315 . . . . 51.409999999999997 111.133 -179.85 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.436 HG21 HD23 ' A' ' 32' ' ' LEU . 23.3 mt -92.51 111.67 24.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.256 -0.429 . . . . 64.25 111.128 179.941 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.698 HG22 HG21 ' A' ' 62' ' ' THR . 19.6 p -97.78 178.21 5.22 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.2 -0.454 . . . . 72.319999999999993 111.093 -179.989 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 3.0 p -62.77 -27.19 69.12 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.205 -0.452 . . . . 73.239999999999995 111.184 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 7.8 mmmm -69.78 -50.09 46.56 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.173 -0.467 . . . . 42.100000000000001 110.899 179.93 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.42 ' O ' HG23 ' A' ' 35' ' ' VAL . 33.6 mt-10 -74.24 -32.71 63.08 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.214 -0.448 . . . . 74.120000000000005 110.899 179.95 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.576 ' O ' HD13 ' A' ' 32' ' ' LEU . 1.0 OUTLIER -74.14 -41.26 61.82 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.145 -0.479 . . . . 75.510000000000005 110.912 179.996 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -70.67 -34.43 66.93 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.801 -0.714 . . . . 74.239999999999995 112.5 179.887 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 96.7 m -67.43 -59.88 3.02 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.784 0.326 . . . . 70.299999999999997 111.136 -179.809 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.491 HG11 ' CE1' ' A' ' 19' ' ' PHE . 66.7 t -52.94 -52.11 31.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.194 -0.457 . . . . 72.329999999999998 111.132 179.903 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 6.3 ttt -51.93 -29.97 22.5 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.179 -0.464 . . . . 74.409999999999997 110.902 179.899 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 3.7 tmm_? -72.65 -52.85 13.64 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.17 -0.468 . . . . 71.109999999999999 110.884 -179.971 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 4.6 t -58.52 -25.69 62.69 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.23 -0.441 . . . . 74.329999999999998 110.907 -179.811 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.98 HD13 ' HB3' ' M' ' 37' ' ' ALA . 61.2 mt -78.15 -13.88 59.69 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.101 -0.5 . . . . 64.340000000000003 110.936 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 101.5 23.88 9.19 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.778 -0.725 . . . . 52.350000000000001 112.518 179.936 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 8.3 tp-100 -124.59 129.35 50.4 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.785 0.326 . . . . 72.530000000000001 110.931 -179.904 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 61.1 t30 -109.71 82.46 2.31 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.591 0.71 . . . . 71.129999999999995 110.902 -179.957 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.8 167.97 22.95 Favored 'Trans proline' 0 C--O 1.232 0.221 0 C-N-CA 122.72 2.28 . . . . 52.43 112.324 179.988 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 20.5 p -112.53 155.47 24.27 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.249 -0.432 . . . . 61.329999999999998 111.195 -179.993 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -51.91 -40.51 60.84 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.227 -0.442 . . . . 52.130000000000003 110.886 179.984 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.44 -31.46 63.83 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.145 -0.48 . . . . 73.049999999999997 111.112 179.973 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -70.76 -49.71 43.82 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.217 -0.447 . . . . 73.329999999999998 110.873 -179.933 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.522 ' CD2' HD12 ' A' ' 32' ' ' LEU . 13.9 mt -55.07 -51.0 67.73 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.175 -0.466 . . . . 72.25 110.926 -179.986 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 15.4 tp60 -59.93 -28.39 67.58 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.171 -0.468 . . . . 75.25 110.906 179.928 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 38.3 t0 -74.63 -49.96 19.55 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.22 -0.446 . . . . 52.109999999999999 110.865 -179.996 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 14.6 ptm -66.92 -42.49 85.29 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.212 -0.449 . . . . 64.439999999999998 110.894 179.976 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 97.1 mt -65.83 -38.11 81.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.149 -0.478 . . . . 61.539999999999999 111.12 179.97 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 33.6 m-20 -62.28 -36.17 81.25 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.18 -0.464 . . . . 65.150000000000006 110.847 179.959 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 24.9 mm-40 -63.62 -29.73 70.94 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.216 -0.447 . . . . 64.340000000000003 110.9 -179.963 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 9.7 m -105.34 12.68 8.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.151 -0.477 . . . . 74.439999999999998 111.114 179.967 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 30.7 t0 -90.01 98.73 11.94 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.232 -0.44 . . . . 73.0 110.857 179.953 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.34 -44.71 10.59 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.21 -0.45 . . . . 32.450000000000003 111.1 179.957 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 41.2 p30 -82.93 -0.2 47.43 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.219 -0.446 . . . . 74.140000000000001 110.837 -179.999 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 55.2 55.34 28.78 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.731 -0.747 . . . . 62.399999999999999 112.477 -179.927 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 48.7 p-10 -114.64 -15.74 11.92 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.891 0.376 . . . . 72.219999999999999 110.867 -179.895 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 92.71 19.14 38.39 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.799 -0.715 . . . . 62.409999999999997 112.478 179.96 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . 0.698 HG21 HG22 ' A' ' 28' ' ' THR . 26.7 p -146.52 165.91 28.04 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.749 0.309 . . . . 43.240000000000002 111.148 -179.881 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.434 HD13 HD21 ' M' ' 31' ' ' LEU . 18.5 mt -96.23 109.43 22.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.219 -0.446 . . . . 72.329999999999998 111.132 179.915 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -74.04 -177.81 3.06 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.205 -0.452 . . . . 65.409999999999997 110.901 179.839 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.533 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 2.5 t80 -61.6 -58.35 18.98 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.636 0.731 . . . . 60.439999999999998 110.891 -179.886 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . 0.533 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 53.9 Cg_endo -69.78 -29.73 23.3 Favored 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.668 2.245 . . . . 65.510000000000005 112.299 -179.991 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 80.6 mt-10 -58.57 -40.02 81.95 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.268 -0.424 . . . . 73.019999999999996 110.868 -179.963 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 50.4 t80 -73.79 -36.05 65.0 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.119 -0.491 . . . . 72.400000000000006 110.894 -179.923 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 16.4 tp -68.84 -53.84 19.12 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.177 -0.465 . . . . 73.25 110.932 -179.976 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 14.1 t -52.9 -28.45 23.34 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.214 -0.448 . . . . 74.120000000000005 111.154 179.964 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 39.6 ttp -65.24 -42.46 93.35 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.231 -0.441 . . . . 71.430000000000007 110.873 179.876 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -71.97 -35.75 69.61 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.218 -0.447 . . . . 62.229999999999997 110.848 179.975 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.237 -0.438 . . . . 70.430000000000007 111.078 179.926 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.438 HG21 HG22 ' A' ' 142' ' ' VAL . 51.4 mt . . . . . 0 C--O 1.23 0.07 0 CA-C-O 120.831 0.348 . . . . 74.140000000000001 111.181 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 51.2 ttt180 -66.04 -33.5 75.94 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.131 -0.486 . . . . 75.209999999999994 110.847 179.969 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.681 ' O ' HG23 ' A' ' 91' ' ' VAL . 0.3 OUTLIER -76.41 -34.94 58.8 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.241 -0.436 . . . . 70.420000000000002 110.878 -179.912 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . 0.418 ' HB1' ' CE2' ' A' ' 92' ' ' PHE . . . -76.62 -34.49 58.35 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.149 -0.478 . . . . 45.039999999999999 111.086 179.94 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -61.57 -48.63 80.08 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.216 -0.447 . . . . 71.540000000000006 110.879 -179.936 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 12.9 ptm180 -60.76 -25.93 66.85 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.168 -0.469 . . . . 73.239999999999995 110.865 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . 0.681 HG23 ' O ' ' A' ' 87' ' ' GLU . 94.0 t -75.58 -51.21 21.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.234 -0.439 . . . . 73.049999999999997 111.136 179.98 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.455 ' CE1' HG11 ' A' ' 108' ' ' VAL . 8.9 m-85 -70.79 -26.61 63.4 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.184 -0.462 . . . . 73.409999999999997 110.882 -179.983 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 33.1 t0 -76.52 88.91 3.26 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.157 -0.474 . . . . 71.129999999999995 110.864 179.954 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 59.4 mmtt -75.31 -51.04 14.17 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.203 -0.453 . . . . 72.329999999999998 110.914 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 31.2 p30 -72.58 -9.08 58.15 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.233 -0.439 . . . . 51.520000000000003 110.882 179.857 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 59.96 27.72 65.06 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.765 -0.731 . . . . 73.420000000000002 112.527 -179.9 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 44.7 p-10 -82.88 -16.12 48.79 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.899 0.38 . . . . 74.5 110.909 -179.878 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 89.08 18.72 53.22 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.752 -0.737 . . . . 73.230000000000004 112.491 179.981 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 20.2 m-85 -137.51 152.39 49.44 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.824 0.345 . . . . 71.439999999999998 110.945 -179.798 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 65.2 mt -122.63 114.64 43.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.135 -0.484 . . . . 74.040000000000006 111.152 179.916 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 6.8 p -107.19 165.43 11.37 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.208 -0.451 . . . . 53.310000000000002 110.87 -179.926 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . 0.502 ' HB2' HG13 ' A' ' 125' ' ' ILE . . . -51.85 -29.83 21.21 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.136 -0.484 . . . . 50.310000000000002 111.11 179.904 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -68.92 -43.11 75.83 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.191 -0.459 . . . . 61.020000000000003 111.096 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 83.5 mt-10 -76.8 -49.4 15.95 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.185 -0.461 . . . . 55.549999999999997 110.916 -179.956 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 24.3 tp -53.31 -47.62 69.1 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.187 -0.46 . . . . 72.340000000000003 110.891 -179.981 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . 0.75 ' HB2' HG21 ' A' ' 121' ' ' VAL . 46.9 ttp180 -53.02 -31.31 40.45 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.219 -0.446 . . . . 73.519999999999996 110.887 179.954 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 63.0 t60 -69.27 -34.41 74.72 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.168 -0.469 . . . . 74.140000000000001 110.889 179.977 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.455 HG11 ' CE1' ' A' ' 92' ' ' PHE . 45.3 t -70.0 -32.24 50.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.238 -0.437 . . . . 75.420000000000002 111.113 -179.989 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 7.8 mmt -73.09 -43.75 61.36 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.158 -0.473 . . . . 63.329999999999998 110.844 179.931 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -54.99 -41.13 70.86 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.243 -0.435 . . . . 71.310000000000002 111.145 -179.907 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 61.0 m-20 -71.57 -32.24 67.86 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.203 -0.453 . . . . 72.409999999999997 110.88 179.997 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 5.0 mt -70.75 -25.75 63.05 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.148 -0.478 . . . . 75.439999999999998 110.923 179.959 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 101.07 32.42 5.3 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.787 -0.72 . . . . 65.209999999999994 112.454 179.88 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -113.75 109.97 19.42 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.896 0.379 . . . . 72.25 110.875 -179.861 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . 0.418 ' O ' HD23 ' A' ' 116' ' ' LEU . 0.6 OUTLIER -66.61 108.08 2.32 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.159 -0.473 . . . . 63.530000000000001 110.876 179.984 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.603 HD22 ' HG2' ' A' ' 120' ' ' GLU . 10.4 mt -143.63 160.38 40.77 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.218 -0.446 . . . . 55.109999999999999 110.954 179.894 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . 0.557 ' O ' HG23 ' A' ' 121' ' ' VAL . 31.9 p -118.86 177.01 5.01 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.217 -0.447 . . . . 73.200000000000003 111.139 179.986 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -57.05 -43.74 82.3 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.245 -0.434 . . . . 65.299999999999997 110.845 179.938 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -65.0 -33.44 76.06 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.212 -0.449 . . . . 71.310000000000002 110.845 -179.87 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . 0.603 ' HG2' HD22 ' A' ' 116' ' ' LEU . 1.2 tp10 -70.12 -43.92 70.0 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.143 -0.48 . . . . 72.25 110.926 -179.974 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.75 HG21 ' HB2' ' A' ' 106' ' ' ARG . 48.6 t -59.19 -31.94 47.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.155 -0.475 . . . . 54.399999999999999 111.114 179.976 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 11.7 t0 -52.01 -42.77 63.28 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.226 -0.443 . . . . 74.040000000000006 110.856 179.916 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -55.76 -32.65 63.61 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.179 -0.464 . . . . 73.5 110.895 -179.909 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 30.8 mtp -76.05 -59.17 2.88 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.164 -0.471 . . . . 71.109999999999999 110.882 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.502 HG13 ' HB2' ' A' ' 102' ' ' ALA . 36.0 mm -53.92 -35.73 28.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.218 -0.446 . . . . 73.5 111.12 179.931 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 24.0 ttm180 -63.44 -31.85 73.13 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.178 -0.464 . . . . 74.150000000000006 110.898 179.944 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 21.0 tp10 -74.75 -52.38 11.68 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.161 -0.472 . . . . 72.209999999999994 110.842 -179.901 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.653 ' HB3' HG22 ' A' ' 136' ' ' VAL . . . -65.21 -34.41 78.3 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.159 -0.473 . . . . 75.329999999999998 111.088 179.982 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 49.4 t0 -68.42 86.74 0.3 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.217 -0.447 . . . . 51.329999999999998 110.882 179.968 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 60.6 mt -79.81 -46.15 22.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.172 -0.467 . . . . 71.519999999999996 111.126 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 21.2 p30 -72.78 -8.7 56.7 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.151 -0.477 . . . . 51.439999999999998 110.874 179.864 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 62.7 42.97 99.61 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.692 -0.766 . . . . 70.200000000000003 112.505 -179.933 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 34.6 p-10 -88.05 -15.98 34.84 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.825 0.345 . . . . 71.299999999999997 110.877 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 103.98 2.41 45.58 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.761 -0.733 . . . . 73.129999999999995 112.501 -179.935 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -149.15 172.26 15.11 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.829 0.347 . . . . 74.140000000000001 110.939 -179.88 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 136' ' ' VAL . . . . . 0.653 HG22 ' HB3' ' A' ' 128' ' ' ALA . 95.6 t -107.8 111.06 34.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.204 -0.453 . . . . 74.200000000000003 111.127 179.939 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 44.2 p-10 -92.82 165.95 12.66 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.153 -0.476 . . . . 64.109999999999999 110.88 -179.967 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 138' ' ' TYR . . . . . 0.518 ' O ' HG23 ' A' ' 142' ' ' VAL . 58.9 t80 -51.97 -46.47 64.84 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.207 -0.451 . . . . 75.109999999999999 110.905 -179.906 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 -51.99 -40.89 61.65 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.113 -0.494 . . . . 72.150000000000006 110.867 -179.956 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 20.7 mt-10 -78.34 -39.81 38.36 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.2 -0.455 . . . . 62.439999999999998 110.876 -179.926 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 52.4 t80 -61.17 -38.66 87.29 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.15 -0.477 . . . . 74.439999999999998 110.87 -179.888 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . 0.518 HG23 ' O ' ' A' ' 138' ' ' TYR . 93.8 t -71.26 -37.95 68.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.119 -0.491 . . . . 54.439999999999998 111.11 179.961 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 3.4 tp-100 -71.56 -31.25 66.79 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.185 -0.461 . . . . 54.210000000000001 110.895 -179.955 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 9.0 tpt -74.7 -42.43 58.39 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.193 -0.458 . . . . 73.540000000000006 110.867 179.964 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 9.6 ttm -79.34 -26.07 42.19 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.236 -0.438 . . . . 71.340000000000003 110.875 179.967 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 2.6 m . . . . . 0 C--N 1.329 -0.291 0 CA-C-N 116.23 -0.441 . . . . 62.210000000000001 111.14 -179.924 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' M' M ' 15' ' ' LYS . . . . . . . . . . . . . 60.9 mttp . . . . . 0 C--O 1.231 0.081 0 CA-C-O 120.744 0.307 . . . . 73.230000000000004 110.894 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' M' M ' 16' ' ' TRP . . . . . 0.468 ' CE3' HD12 ' M' ' 19' ' ' ILE . 19.7 m95 -54.34 -39.31 66.96 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.244 -0.434 . . . . 71.450000000000003 110.862 179.983 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' M' M ' 17' ' ' GLU . . . . . . . . . . . . . 41.0 tp10 -56.45 -26.81 54.97 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.243 -0.435 . . . . 62.420000000000002 110.883 -179.974 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' M' M ' 18' ' ' LYS . . . . . . . . . . . . . 6.9 ttpm? -78.61 -25.87 45.21 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.171 -0.468 . . . . 73.209999999999994 110.897 179.984 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' M' M ' 19' ' ' ILE . . . . . 0.468 HD12 ' CE3' ' M' ' 16' ' ' TRP . 29.6 mt -89.88 -25.22 5.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.187 -0.46 . . . . 71.109999999999999 111.14 179.874 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' M' M ' 20' ' ' ARG . . . . . . . . . . . . . 22.5 ttt180 . . . . . 0 C--N 1.329 -0.303 0 CA-C-N 116.174 -0.466 . . . . 73.439999999999998 110.903 179.956 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' M' M ' 30' ' ' LYS . . . . . . . . . . . . . 3.0 ttmm . . . . . 0 C--O 1.232 0.136 0 CA-C-O 120.783 0.325 . . . . 74.239999999999995 110.892 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' M' M ' 31' ' ' LEU . . . . . 0.434 HD21 HD13 ' A' ' 63' ' ' ILE . 9.5 tp -127.33 -52.28 1.39 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.196 -0.456 . . . . 75.439999999999998 110.933 179.926 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' M' M ' 32' ' ' LYS . . . . . . . . . . . . . 3.2 ttpp -47.65 -47.08 29.41 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.212 -0.449 . . . . 63.539999999999999 110.918 179.792 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' M' M ' 33' ' ' HIS . . . . . . . . . . . . . 74.8 t60 -50.45 -39.87 48.93 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.201 -0.454 . . . . 70.109999999999999 110.838 179.924 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' M' M ' 34' ' ' ILE . . . . . . . . . . . . . 50.1 mt -50.73 -39.27 18.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.236 -0.438 . . . . 65.420000000000002 111.123 -180.0 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' M' M ' 35' ' ' VAL . . . . . . . . . . . . . 61.1 t -49.27 -39.93 13.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.194 -0.457 . . . . 75.519999999999996 111.098 179.895 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' M' M ' 36' ' ' TRP . . . . . . . . . . . . . 22.8 m0 -59.02 -39.5 82.12 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.168 -0.469 . . . . 71.510000000000005 110.95 179.958 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' M' M ' 37' ' ' ALA . . . . . 0.98 ' HB3' HD13 ' A' ' 39' ' ' LEU . . . -63.71 -18.69 64.28 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.205 -0.452 . . . . 74.25 111.069 179.874 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' M' M ' 38' ' ' SER . . . . . 0.64 ' HB3' HD23 ' A' ' 18' ' ' LEU . 1.2 m -69.3 -17.96 63.78 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.24 -0.436 . . . . 72.5 110.871 -179.769 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' M' M ' 39' ' ' ARG . . . . . . . . . . . . . 26.4 ptt180 -56.11 -25.38 45.64 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.107 -0.497 . . . . 74.150000000000006 110.877 -179.916 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' M' M ' 40' ' ' GLU . . . . . . . . . . . . . 41.6 mm-40 -88.1 -47.99 8.07 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.188 -0.46 . . . . 42.340000000000003 110.914 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' M' M ' 41' ' ' LEU . . . . . . . . . . . . . 12.9 mt . . . . . 0 C--N 1.328 -0.34 0 CA-C-N 116.165 -0.47 . . . . 70.310000000000002 110.97 179.956 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 8.0 tp60 . . . . . 0 C--O 1.231 0.118 0 CA-C-O 120.784 0.326 . . . . 71.030000000000001 110.908 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 59.4 mt -72.56 -38.39 59.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.199 -0.455 . . . . 72.219999999999999 111.088 179.989 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -65.91 -27.02 67.88 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.228 -0.442 . . . . 54.310000000000002 111.137 179.807 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 20.6 mm-40 -74.83 -44.75 47.56 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.173 -0.467 . . . . 65.230000000000004 110.9 -179.933 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 23.8 m-85 -75.26 -45.81 37.68 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.157 -0.474 . . . . 61.020000000000003 110.853 -179.913 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 27.0 ttmt -56.36 -44.53 80.2 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.149 -0.478 . . . . 73.340000000000003 110.888 179.976 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -52.99 -32.65 47.61 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.202 -0.454 . . . . 72.400000000000006 110.84 -179.993 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -67.51 -42.2 83.23 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.193 -0.458 . . . . 72.040000000000006 111.109 179.916 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 66.6 t80 -56.07 -53.51 56.18 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.199 -0.455 . . . . 61.32 110.899 -179.914 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 70.9 m -55.85 -27.21 50.54 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.141 -0.481 . . . . 41.229999999999997 110.855 -179.796 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 15.5 tp -67.77 -40.25 84.04 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.182 -0.463 . . . . 71.349999999999994 110.947 179.964 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.672 ' HA ' HG21 ' A' ' 35' ' ' VAL . 59.5 m-85 -82.43 -34.48 28.2 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.228 -0.442 . . . . 75.109999999999999 110.853 179.93 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 11.0 t0 -69.47 98.52 1.12 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.192 -0.458 . . . . 64.209999999999994 110.859 -179.999 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 45.4 mmtt -72.09 -56.14 6.12 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.169 -0.469 . . . . 63.240000000000002 110.869 -179.978 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 26.5 p-10 -73.94 -10.01 59.22 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.2 -0.455 . . . . 53.409999999999997 110.876 179.893 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 51.99 44.6 56.41 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.762 -0.732 . . . . 74.129999999999995 112.529 -179.9 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 26.5 p-10 -88.51 -15.77 34.41 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.878 0.371 . . . . 72.530000000000001 110.89 -179.979 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 104.67 -11.72 50.08 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.74 -0.743 . . . . 72.019999999999996 112.47 -179.953 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 20.7 p -131.04 130.68 43.58 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.715 0.293 . . . . 74.310000000000002 111.166 -179.851 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 21.2 mt -90.47 130.84 39.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.292 -0.413 . . . . 62.439999999999998 111.096 179.919 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 29.8 p -108.75 -176.83 3.15 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.188 -0.46 . . . . 73.129999999999995 111.141 179.963 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.512 HG23 HD12 ' A' ' 52' ' ' ILE . 7.6 p -65.61 -41.5 92.69 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.247 -0.433 . . . . 73.209999999999994 111.126 -179.985 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 79.8 mttt -68.23 -50.15 55.91 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.206 -0.452 . . . . 73.150000000000006 110.902 179.935 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 27.4 mt-10 -56.36 -32.65 64.94 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.187 -0.461 . . . . 72.040000000000006 110.882 179.992 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.559 ' O ' HD13 ' A' ' 32' ' ' LEU . 0.9 OUTLIER -73.13 -43.14 62.07 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.156 -0.475 . . . . 50.229999999999997 110.926 179.988 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -69.73 -27.86 72.77 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.742 -0.742 . . . . 73.219999999999999 112.448 179.933 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 46.6 m -64.68 -59.51 4.18 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.841 0.353 . . . . 42.130000000000003 111.177 -179.896 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.672 HG21 ' HA ' ' A' ' 19' ' ' PHE . 99.9 t -57.38 -50.35 77.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.233 -0.439 . . . . 64.430000000000007 111.169 179.864 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 1.9 ttt -55.08 -30.42 59.63 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.166 -0.47 . . . . 75.109999999999999 110.907 179.88 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 23.9 ttm180 -60.1 -50.67 72.8 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.223 -0.444 . . . . 73.530000000000001 110.9 -179.96 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . 0.587 ' OG ' HD21 ' M' ' 41' ' ' LEU . 1.6 t -61.34 -26.17 67.64 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.16 -0.473 . . . . 63.039999999999999 110.853 -179.751 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 1.0 HD13 ' HB3' ' M' ' 37' ' ' ALA . 58.2 mt -73.84 -20.5 60.42 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.096 -0.502 . . . . 71.150000000000006 110.93 179.963 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 101.5 29.62 6.21 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.715 -0.755 . . . . 75.230000000000004 112.467 179.886 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 10.5 mm-40 -127.46 133.97 49.87 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.796 0.331 . . . . 73.120000000000005 110.918 -179.882 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 10.7 t-20 -109.27 86.24 4.03 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.609 0.718 . . . . 70.129999999999995 110.875 -179.984 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.78 167.89 23.16 Favored 'Trans proline' 0 C--O 1.231 0.167 0 C-N-CA 122.709 2.272 . . . . 75.030000000000001 112.306 179.934 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 19.3 p -111.79 156.49 21.89 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.187 -0.461 . . . . 54.240000000000002 111.152 179.997 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 12.3 tp10 -51.97 -40.81 61.47 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.244 -0.435 . . . . 74.230000000000004 110.882 179.973 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.32 -39.37 65.33 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.159 -0.473 . . . . 40.039999999999999 111.109 179.943 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -60.47 -52.58 64.58 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.258 -0.428 . . . . 71.040000000000006 110.886 -179.924 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.43 ' CD2' HD12 ' A' ' 32' ' ' LEU . 19.7 mt -55.27 -48.52 73.89 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.163 -0.471 . . . . 74.219999999999999 110.89 -179.956 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.407 HE22 ' ND2' ' A' ' 53' ' ' ASN . 0.0 OUTLIER -54.84 -41.94 71.33 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.196 -0.456 . . . . 40.020000000000003 110.894 179.977 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 51.0 t0 -57.99 -43.2 86.45 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.175 -0.466 . . . . 72.040000000000006 110.878 179.949 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 5.8 mtp -62.9 -55.36 26.75 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.205 -0.452 . . . . 72.329999999999998 110.873 179.989 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.512 HD12 HG23 ' A' ' 29' ' ' THR . 65.5 mt -53.24 -53.66 22.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.201 -0.454 . . . . 75.230000000000004 111.144 179.95 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . 0.407 ' ND2' HE22 ' A' ' 49' ' ' GLN . 6.5 m-20 -61.73 -37.67 85.06 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.203 -0.453 . . . . 71.219999999999999 110.88 179.936 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 -60.02 -33.16 71.64 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.163 -0.471 . . . . 72.310000000000002 110.914 179.986 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.489 HG11 ' SD ' ' A' ' 71' ' ' MET . 32.8 m -109.97 20.2 6.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.126 -0.488 . . . . 71.310000000000002 111.141 179.95 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 29.3 t0 -90.11 99.15 12.22 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.157 -0.474 . . . . 63.299999999999997 110.83 179.947 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.35 -40.19 13.76 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.163 -0.471 . . . . 63.43 111.071 179.956 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 13.0 p-10 -86.64 -0.12 55.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.235 -0.439 . . . . 74.420000000000002 110.859 179.981 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 52.46 56.81 15.8 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.738 -0.744 . . . . 71.209999999999994 112.504 -179.911 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 52.1 p-10 -114.48 -15.89 11.99 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.877 0.37 . . . . 71.120000000000005 110.921 -179.93 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . 0.498 ' O ' HG21 ' A' ' 52' ' ' ILE . . . 91.65 17.79 47.38 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.695 -0.764 . . . . 64.209999999999994 112.445 179.981 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 25.1 p -150.49 162.38 40.71 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.721 0.296 . . . . 75.239999999999995 111.168 -179.814 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.419 HG21 ' HD1' ' A' ' 68' ' ' PHE . 20.3 mt -97.86 109.39 23.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.242 -0.435 . . . . 74.109999999999999 111.121 179.941 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -75.84 -172.69 2.01 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.218 -0.447 . . . . 73.430000000000007 110.864 179.878 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.535 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 2.5 t80 -64.91 -58.15 13.77 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.644 0.735 . . . . 74.540000000000006 110.909 -179.948 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . 0.535 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 54.3 Cg_endo -69.71 -27.83 26.25 Favored 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.669 2.246 . . . . 51.32 112.364 179.977 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 14.0 mt-10 -59.75 -41.06 90.13 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.221 -0.445 . . . . 73.239999999999995 110.864 -179.939 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . 0.419 ' HD1' HG21 ' A' ' 63' ' ' ILE . 24.0 t80 -73.99 -36.11 64.49 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.164 -0.471 . . . . 63.310000000000002 110.924 -179.982 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 24.0 tp -68.14 -53.89 21.92 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.141 -0.481 . . . . 74.420000000000002 110.921 -179.987 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 14.8 t -54.92 -30.85 59.47 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.2 -0.455 . . . . 64.230000000000004 111.124 179.972 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . 0.489 ' SD ' HG11 ' A' ' 55' ' ' VAL . 44.1 ttp -58.94 -38.3 78.69 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.216 -0.447 . . . . 73.420000000000002 110.86 179.919 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -75.65 -36.66 60.09 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.214 -0.448 . . . . 63.140000000000001 110.884 179.965 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.296 0 CA-C-N 116.224 -0.444 . . . . 70.129999999999995 111.085 179.92 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 76.5 mt . . . . . 0 N--CA 1.458 -0.071 0 CA-C-O 120.807 0.336 . . . . 55.340000000000003 111.11 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 25.9 ttt85 -71.44 -42.27 68.43 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.138 -0.483 . . . . 73.439999999999998 110.859 179.962 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.742 ' O ' HG23 ' A' ' 91' ' ' VAL . 18.0 tt0 -62.31 -56.93 13.67 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.215 -0.448 . . . . 61.140000000000001 110.89 -179.896 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . 0.469 ' HB1' ' CE2' ' A' ' 92' ' ' PHE . . . -53.35 -51.03 63.75 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.152 -0.476 . . . . 74.209999999999994 111.082 179.935 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 17.1 t80 -53.16 -43.41 67.03 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.2 -0.455 . . . . 73.140000000000001 110.933 -179.928 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 59.6 ttp180 -69.19 -34.29 74.69 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.127 -0.488 . . . . 72.129999999999995 110.846 -179.886 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . 0.742 HG23 ' O ' ' A' ' 87' ' ' GLU . 96.1 t -66.07 -40.73 88.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.139 -0.482 . . . . 74.099999999999994 111.167 179.967 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.469 ' CE2' ' HB1' ' A' ' 88' ' ' ALA . 8.3 m-85 -76.81 -31.92 57.27 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.129 -0.487 . . . . 75.129999999999995 110.843 -179.972 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 21.5 t0 -71.29 85.4 0.79 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.158 -0.473 . . . . 54.32 110.869 -180.0 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 11.5 ptpt -78.72 -40.58 33.25 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.175 -0.466 . . . . 74.329999999999998 110.876 -179.995 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 55.2 p-10 -75.01 -9.17 58.28 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.202 -0.454 . . . . 60.43 110.842 179.883 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 59.55 26.81 62.72 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.74 -0.743 . . . . 71.340000000000003 112.504 -179.885 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 35.8 p-10 -84.22 -16.13 44.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.879 0.371 . . . . 71.340000000000003 110.888 -179.901 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 80.98 18.26 70.25 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.744 -0.741 . . . . 70.549999999999997 112.482 -179.996 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 20.7 m-85 -140.83 142.24 34.61 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.84 0.352 . . . . 72.140000000000001 110.948 -179.789 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 62.3 mt -103.48 126.44 57.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.172 -0.467 . . . . 75.109999999999999 111.12 179.913 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 93.0 p -107.28 -175.63 2.84 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.193 -0.458 . . . . 70.400000000000006 110.896 -179.942 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . 0.66 ' O ' HG11 ' A' ' 121' ' ' VAL . . . -73.27 -31.56 64.16 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.115 -0.493 . . . . 74.209999999999994 111.088 179.928 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -71.07 -47.08 60.41 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.234 -0.439 . . . . 72.120000000000005 111.087 179.935 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . 0.43 ' O ' HG23 ' A' ' 108' ' ' VAL . 69.9 mt-10 -69.16 -44.02 73.12 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.254 -0.43 . . . . 75.510000000000005 110.917 -179.914 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 35.8 tp -53.42 -42.32 66.94 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.104 -0.498 . . . . 62.530000000000001 110.928 -179.989 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . 0.605 ' HB2' HG21 ' A' ' 121' ' ' VAL . 8.9 ttt-85 -63.98 -49.33 72.94 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.223 -0.444 . . . . 73.530000000000001 110.858 179.975 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 18.9 t60 -54.22 -34.39 60.52 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.212 -0.449 . . . . 61.350000000000001 110.877 179.951 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.43 HG23 ' O ' ' A' ' 104' ' ' GLU . 95.2 t -73.34 -29.98 29.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.194 -0.457 . . . . 71.209999999999994 111.098 179.995 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 44.4 tpp -73.29 -53.76 10.06 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.226 -0.443 . . . . 63.140000000000001 110.884 179.939 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 2.1 t -51.75 -30.18 21.66 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.198 -0.455 . . . . 75.439999999999998 111.13 -179.923 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 6.7 m120 -65.06 -37.45 87.6 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.2 -0.455 . . . . 55.43 110.932 179.979 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 17.3 mt -72.12 -9.72 58.8 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.182 -0.463 . . . . 62.130000000000003 110.916 179.919 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 101.08 29.18 6.53 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.736 -0.745 . . . . 74.439999999999998 112.503 179.923 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 12.4 tp10 -133.01 110.06 9.98 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.953 0.406 . . . . 72.439999999999998 110.885 -179.907 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 31.0 tttt -85.69 120.42 27.1 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.133 -0.485 . . . . 73.319999999999993 110.879 179.96 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.801 HD22 ' HG2' ' A' ' 120' ' ' GLU . 61.1 mt -124.54 153.58 41.9 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.191 -0.459 . . . . 74.319999999999993 110.921 179.895 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 45.5 p -89.55 162.83 15.47 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.18 -0.464 . . . . 65.219999999999999 111.154 179.964 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 94.7 m-20 -53.56 -38.78 64.19 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.206 -0.452 . . . . 41.409999999999997 110.882 179.935 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -68.23 -34.3 75.98 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.186 -0.461 . . . . 73.219999999999999 110.92 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . 0.801 ' HG2' HD22 ' A' ' 116' ' ' LEU . 19.9 tp10 -67.12 -42.3 84.75 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.117 -0.492 . . . . 73.219999999999999 110.902 -179.962 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.66 HG11 ' O ' ' A' ' 102' ' ' ALA . 63.6 t -60.34 -34.54 57.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.124 -0.489 . . . . 64.409999999999997 111.127 179.976 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -51.95 -46.95 64.95 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.199 -0.455 . . . . 63.130000000000003 110.837 179.92 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 35.2 tp10 -57.6 -29.26 64.36 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.214 -0.448 . . . . 75.299999999999997 110.867 -179.875 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 35.4 mtp -75.96 -58.06 3.5 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.162 -0.472 . . . . 73.049999999999997 110.862 -179.996 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 33.3 mm -54.0 -35.31 28.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.213 -0.449 . . . . 73.310000000000002 111.109 179.982 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 51.8 ttm-85 -69.01 -31.72 70.75 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.199 -0.455 . . . . 71.120000000000005 110.897 179.952 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -69.01 -40.5 78.65 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.134 -0.485 . . . . 72.549999999999997 110.888 -179.944 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.522 ' HB3' HG22 ' A' ' 136' ' ' VAL . . . -83.82 -27.34 28.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.133 -0.485 . . . . 73.329999999999998 111.105 179.946 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 50.7 t0 -74.54 86.6 2.09 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.21 -0.45 . . . . 73.340000000000003 110.881 179.944 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 90.1 mt -80.08 -45.57 22.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.239 -0.437 . . . . 61.409999999999997 111.152 179.966 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 16.6 p30 -71.43 -8.93 57.05 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.152 -0.476 . . . . 54.409999999999997 110.83 179.916 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 63.13 43.01 99.33 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.711 -0.756 . . . . 30.420000000000002 112.49 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 17.2 p-10 -88.9 -15.91 33.2 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.864 0.364 . . . . 73.299999999999997 110.826 -179.934 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 100.36 5.33 54.45 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.721 -0.752 . . . . 63.409999999999997 112.434 -179.966 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -149.33 172.16 15.35 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.821 0.343 . . . . 74.420000000000002 110.918 -179.823 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 136' ' ' VAL . . . . . 0.522 HG22 ' HB3' ' A' ' 128' ' ' ALA . 98.4 t -113.63 115.97 51.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.234 -0.439 . . . . 65.219999999999999 111.097 -179.991 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 45.9 p-10 -93.87 167.83 11.37 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.183 -0.462 . . . . 73.109999999999999 110.862 179.978 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 138' ' ' TYR . . . . . 0.709 ' O ' HG23 ' A' ' 142' ' ' VAL . 61.3 t80 -53.2 -41.94 65.8 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.159 -0.473 . . . . 75.129999999999995 110.948 -179.958 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 22.9 tp10 -57.11 -40.62 77.43 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.119 -0.491 . . . . 63.140000000000001 110.927 180.0 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -78.52 -29.94 46.79 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.088 -0.505 . . . . 75.099999999999994 110.859 -179.934 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 53.7 t80 -71.97 -37.1 69.97 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.184 -0.462 . . . . 74.450000000000003 110.918 -179.938 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . 0.709 HG23 ' O ' ' A' ' 138' ' ' TYR . 85.7 t -64.74 -44.94 96.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.12 -0.491 . . . . 62.119999999999997 111.165 179.929 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 42.2 tt0 -63.04 -27.97 69.77 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.161 -0.472 . . . . 63.219999999999999 110.906 -179.988 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 3.9 tpt -74.61 -54.96 6.45 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.183 -0.462 . . . . 75.010000000000005 110.859 180.0 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 12.8 ttm -65.54 -27.23 68.3 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.217 -0.447 . . . . 60.43 110.871 179.951 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 1.3 m . . . . . 0 C--N 1.329 -0.309 0 CA-C-N 116.243 -0.435 . . . . 63.350000000000001 111.149 -179.916 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' M' M ' 15' ' ' LYS . . . . . 0.455 ' CD ' HD11 ' A' ' 116' ' ' LEU . 16.2 mttm . . . . . 0 C--O 1.232 0.157 0 CA-C-O 120.777 0.322 . . . . 73.430000000000007 110.904 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' M' M ' 16' ' ' TRP . . . . . . . . . . . . . 34.3 m95 -52.06 -39.08 59.12 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.257 -0.428 . . . . 70.140000000000001 110.872 179.977 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' M' M ' 17' ' ' GLU . . . . . . . . . . . . . 17.2 tt0 -55.73 -34.2 64.94 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.255 -0.429 . . . . 71.319999999999993 110.89 -179.977 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' M' M ' 18' ' ' LYS . . . . . . . . . . . . . 6.3 ttmm -68.52 -22.18 64.53 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.198 -0.456 . . . . 75.230000000000004 110.862 -179.995 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' M' M ' 19' ' ' ILE . . . . . . . . . . . . . 24.2 mm -69.76 -33.61 57.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.192 -0.458 . . . . 50.0 111.119 179.868 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' M' M ' 20' ' ' ARG . . . . . . . . . . . . . 35.0 ttp180 . . . . . 0 C--N 1.329 -0.31 0 CA-C-N 116.194 -0.457 . . . . 73.219999999999999 110.871 179.978 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' M' M ' 30' ' ' LYS . . . . . . . . . . . . . 9.2 tttt . . . . . 0 C--O 1.232 0.164 0 CA-C-O 120.785 0.326 . . . . 64.319999999999993 110.88 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' M' M ' 31' ' ' LEU . . . . . 0.723 ' CD1' HD12 ' M' ' 34' ' ' ILE . 8.1 tp -96.47 -36.19 10.88 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.279 -0.418 . . . . 74.140000000000001 110.914 179.959 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' M' M ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -47.41 -34.4 7.11 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.139 -0.482 . . . . 63.240000000000002 110.886 179.855 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' M' M ' 33' ' ' HIS . . . . . . . . . . . . . 3.4 t60 -52.02 -45.78 64.72 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.212 -0.449 . . . . 74.230000000000004 110.868 179.926 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' M' M ' 34' ' ' ILE . . . . . 0.723 HD12 ' CD1' ' M' ' 31' ' ' LEU . 60.8 mt -51.82 -35.32 17.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.142 -0.481 . . . . 74.049999999999997 111.136 179.97 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' M' M ' 35' ' ' VAL . . . . . . . . . . . . . 46.2 t -49.95 -39.58 15.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.194 -0.457 . . . . 75.409999999999997 111.143 179.865 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' M' M ' 36' ' ' TRP . . . . . . . . . . . . . 18.3 m0 -58.79 -39.48 81.18 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.14 -0.482 . . . . 75.239999999999995 110.976 179.907 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' M' M ' 37' ' ' ALA . . . . . 1.0 ' HB3' HD13 ' A' ' 39' ' ' LEU . . . -63.85 -18.52 64.24 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.229 -0.441 . . . . 22.109999999999999 111.102 179.859 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' M' M ' 38' ' ' SER . . . . . . . . . . . . . 1.4 m -68.75 -17.81 64.11 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.242 -0.435 . . . . 62.030000000000001 110.842 -179.765 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' M' M ' 39' ' ' ARG . . . . . . . . . . . . . 51.3 mtp85 -51.73 -29.97 20.62 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.136 -0.484 . . . . 50.43 110.884 -179.968 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' M' M ' 40' ' ' GLU . . . . . . . . . . . . . 28.7 mm-40 -80.07 -47.28 15.09 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.192 -0.458 . . . . 74.319999999999993 110.908 -179.939 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' M' M ' 41' ' ' LEU . . . . . 0.587 HD21 ' OG ' ' A' ' 38' ' ' SER . 8.3 mt . . . . . 0 C--N 1.328 -0.34 0 CA-C-N 116.108 -0.496 . . . . 61.039999999999999 110.932 -179.984 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 8.2 tp-100 . . . . . 0 C--O 1.232 0.163 0 CA-C-O 120.787 0.327 . . . . 74.319999999999993 110.932 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . 0.408 ' H ' HD12 ' A' ' 9' ' ' ILE . 4.4 mp -71.41 -38.64 69.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.217 -0.447 . . . . 71.25 111.134 179.957 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -53.42 -40.13 64.88 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.154 -0.476 . . . . 75.450000000000003 111.127 179.795 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -74.65 -50.48 17.57 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.17 -0.468 . . . . 62.109999999999999 110.884 -179.927 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.591 ' CB ' HD13 ' A' ' 69' ' ' LEU . 16.5 m-85 -55.89 -37.62 69.08 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.16 -0.473 . . . . 62.009999999999998 110.904 -179.926 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 26.1 tttm -54.63 -37.27 65.43 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.155 -0.475 . . . . 75.310000000000002 110.935 179.916 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -68.24 -34.18 75.76 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.239 -0.437 . . . . 74.010000000000005 110.889 179.997 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -67.68 -28.21 67.49 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.141 -0.481 . . . . 32.530000000000001 111.082 179.934 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 91.0 t80 -75.64 -54.22 7.33 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.251 -0.432 . . . . 73.319999999999993 110.863 -179.897 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 9.4 t -54.32 -27.57 36.59 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.209 -0.451 . . . . 72.310000000000002 110.812 -179.769 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 16.3 tp -65.18 -38.87 91.89 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.179 -0.464 . . . . 71.129999999999995 110.928 -179.992 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.686 ' CD1' HG11 ' A' ' 35' ' ' VAL . 19.8 m-85 -81.46 -24.76 36.59 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.198 -0.455 . . . . 71.239999999999995 110.911 179.932 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 11.7 t0 -83.35 98.6 9.55 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.139 -0.482 . . . . 65.120000000000005 110.788 179.996 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 21.1 mmmt -67.27 -50.96 58.4 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.16 -0.473 . . . . 74.209999999999994 110.907 179.933 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 22.2 p-10 -80.93 -10.16 59.75 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.217 -0.447 . . . . 70.109999999999999 110.893 179.86 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 51.64 42.3 51.64 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.746 -0.74 . . . . 74.319999999999993 112.481 -179.969 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 34.1 p-10 -88.25 -15.15 36.64 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.838 0.351 . . . . 75.329999999999998 110.858 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 105.4 -11.18 47.13 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.711 -0.756 . . . . 33.549999999999997 112.502 -179.924 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 7.3 p -127.97 130.75 48.9 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.791 0.329 . . . . 71.5 111.162 -179.882 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.661 HG22 ' HB2' ' A' ' 32' ' ' LEU . 22.0 mt -104.29 109.79 28.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.222 -0.444 . . . . 64.209999999999994 111.127 179.913 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.739 HG22 ' CG2' ' A' ' 62' ' ' THR . 20.1 p -95.47 -176.88 3.9 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.173 -0.467 . . . . 43.310000000000002 111.144 179.964 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.46 HG22 ' CD1' ' A' ' 52' ' ' ILE . 69.5 p -66.11 -27.45 68.06 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.21 -0.45 . . . . 64.200000000000003 111.168 -179.99 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.07 -49.99 17.9 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.172 -0.467 . . . . 62.409999999999997 110.928 179.885 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.704 ' O ' HG23 ' A' ' 35' ' ' VAL . 23.8 mt-10 -70.61 -40.15 73.34 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.198 -0.455 . . . . 71.430000000000007 110.863 179.967 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.661 ' HB2' HG22 ' A' ' 27' ' ' ILE . 3.8 tt -74.31 -49.69 21.93 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.195 -0.457 . . . . 75.230000000000004 110.857 -179.914 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -54.63 -31.5 52.99 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.731 -0.747 . . . . 63.140000000000001 112.509 179.905 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 96.3 m -73.38 -47.04 45.33 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.814 0.34 . . . . 64.019999999999996 111.125 -179.856 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.704 HG23 ' O ' ' A' ' 31' ' ' GLU . 51.7 t -54.54 -54.34 23.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.229 -0.441 . . . . 75.239999999999995 111.151 179.892 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . 0.524 ' HA ' HD12 ' A' ' 39' ' ' LEU . 8.2 ptm -65.72 -36.73 84.44 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.136 -0.484 . . . . 54.420000000000002 110.872 179.932 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 52.4 ttt85 -54.31 -37.31 64.68 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.244 -0.434 . . . . 53.5 110.921 -179.962 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . 0.585 ' OG ' HD11 ' M' ' 41' ' ' LEU . 0.9 OUTLIER -70.04 -23.63 63.13 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.2 -0.455 . . . . 74.329999999999998 110.883 -179.816 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.956 HD13 ' HB3' ' M' ' 37' ' ' ALA . 18.3 mt -85.59 -10.72 55.45 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.121 -0.491 . . . . 73.549999999999997 110.919 179.978 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 101.78 22.49 10.14 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.772 -0.728 . . . . 73.030000000000001 112.482 179.871 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 3.8 mp0 -121.22 96.81 5.24 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.787 0.327 . . . . 74.140000000000001 110.935 -179.891 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 52.5 t30 -109.89 79.34 1.45 Allowed Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.63 0.729 . . . . 71.349999999999994 110.908 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.79 168.21 22.25 Favored 'Trans proline' 0 C--O 1.232 0.205 0 C-N-CA 122.685 2.256 . . . . 71.120000000000005 112.344 179.964 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 24.7 p -79.22 159.9 27.13 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.224 -0.444 . . . . 63.219999999999999 111.146 -179.969 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -51.66 -45.72 63.49 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.197 -0.456 . . . . 73.439999999999998 110.88 -179.958 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -68.42 -31.39 70.7 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.142 -0.481 . . . . 72.030000000000001 111.081 179.969 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 76.9 tt0 -69.7 -44.81 69.65 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.261 -0.427 . . . . 73.109999999999999 110.834 -179.922 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 27.3 mt -56.35 -51.88 66.65 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.165 -0.471 . . . . 70.409999999999997 110.913 -179.958 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 24.2 tp60 -66.1 -28.03 68.51 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.183 -0.462 . . . . 75.140000000000001 110.879 179.958 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 23.4 t0 -56.26 -49.66 73.57 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.183 -0.462 . . . . 60.229999999999997 110.845 -179.977 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . 0.42 ' HE2' ' HB3' ' M' ' 31' ' ' LEU . 8.0 ptp -74.07 -36.91 64.36 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.216 -0.447 . . . . 72.129999999999995 110.934 179.953 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.46 ' CD1' HG22 ' A' ' 29' ' ' THR . 91.1 mt -62.55 -38.27 81.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.218 -0.446 . . . . 71.019999999999996 111.128 179.966 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 15.1 m-20 -66.61 -24.66 66.35 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.181 -0.463 . . . . 73.329999999999998 110.891 179.952 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -76.22 -26.53 56.18 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.129 -0.487 . . . . 71.409999999999997 110.875 179.978 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 4.4 m -108.41 8.39 9.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.202 -0.454 . . . . 64.25 111.161 179.956 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 30.8 t0 -82.99 98.39 9.23 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.15 -0.477 . . . . 74.409999999999997 110.84 179.936 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.28 -43.02 11.87 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.203 -0.453 . . . . 51.439999999999998 111.067 179.961 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 43.5 p30 -84.26 -0.12 51.08 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.191 -0.459 . . . . 70.209999999999994 110.882 179.974 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 54.84 54.8 31.13 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.756 -0.735 . . . . 53.310000000000002 112.497 -179.933 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 49.7 p-10 -114.56 -15.67 11.97 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.875 0.369 . . . . 75.230000000000004 110.893 -179.869 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 94.16 18.56 36.21 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.744 -0.741 . . . . 53.130000000000003 112.527 179.994 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . 0.739 ' CG2' HG22 ' A' ' 28' ' ' THR . 20.4 p -145.62 175.52 10.3 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.776 0.322 . . . . 73.400000000000006 111.082 -179.844 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.447 HG21 ' HD1' ' A' ' 68' ' ' PHE . 18.9 mt -108.75 110.6 32.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.194 -0.457 . . . . 73.450000000000003 111.132 179.922 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.0 t0 -76.02 -172.93 2.15 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.199 -0.455 . . . . 64.230000000000004 110.862 179.9 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.521 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 2.4 t80 -64.76 -58.19 13.96 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-O 121.675 0.75 . . . . 61.329999999999998 110.893 -179.878 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . 0.521 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 54.0 Cg_endo -69.72 -26.8 27.41 Favored 'Trans proline' 0 C--N 1.342 0.208 0 C-N-CA 122.696 2.264 . . . . 65.310000000000002 112.331 179.972 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 63.0 mt-10 -61.59 -40.46 94.85 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.232 -0.44 . . . . 71.150000000000006 110.918 -179.976 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . 0.447 ' HD1' HG21 ' A' ' 63' ' ' ILE . 25.1 t80 -74.44 -35.83 63.37 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.163 -0.471 . . . . 53.43 110.86 -179.93 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.591 HD13 ' CB ' ' A' ' 12' ' ' PHE . 35.3 tp -69.61 -54.06 15.79 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.107 -0.497 . . . . 53.329999999999998 110.914 -179.94 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 14.6 t -52.82 -30.38 33.07 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.182 -0.463 . . . . 62.119999999999997 111.151 179.966 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . 0.481 ' HE1' HD11 ' M' ' 31' ' ' LEU . 39.2 ttp -60.4 -51.23 70.36 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.197 -0.456 . . . . 71.439999999999998 110.88 179.91 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 5.2 mmt -70.24 -46.03 65.28 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.244 -0.434 . . . . 71.109999999999999 110.906 179.956 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.319 0 CA-C-N 116.228 -0.442 . . . . 73.340000000000003 111.093 179.912 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.609 HD13 HG13 ' A' ' 142' ' ' VAL . 68.8 mt . . . . . 0 C--O 1.231 0.097 0 CA-C-O 120.788 0.327 . . . . 72.450000000000003 111.104 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 34.9 ttm180 -63.41 -28.23 69.84 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.2 -0.455 . . . . 73.25 110.855 179.957 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.719 ' O ' HG23 ' A' ' 91' ' ' VAL . 2.3 mm-40 -63.8 -50.91 67.12 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.245 -0.434 . . . . 62.229999999999997 110.84 -179.889 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -66.13 -44.02 85.41 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.195 -0.457 . . . . 75.019999999999996 111.1 179.962 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 5.7 t80 -51.97 -48.02 64.55 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.184 -0.462 . . . . 64.010000000000005 110.863 -179.921 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 4.3 ttt-85 -63.78 -39.9 95.38 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.157 -0.474 . . . . 72.439999999999998 110.864 -179.911 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . 0.719 HG23 ' O ' ' A' ' 87' ' ' GLU . 90.4 t -59.37 -33.53 51.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.213 -0.448 . . . . 72.129999999999995 111.142 179.982 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.551 ' CE1' HG11 ' A' ' 108' ' ' VAL . 8.6 m-85 -89.98 -26.19 20.49 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.191 -0.458 . . . . 63.310000000000002 110.89 -179.986 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 17.1 t0 -73.97 95.6 2.52 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.16 -0.473 . . . . 60.119999999999997 110.834 -179.999 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 13.5 mtpt -78.67 -53.25 7.35 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.224 -0.444 . . . . 74.409999999999997 110.922 179.963 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 48.9 p30 -73.55 -9.15 58.38 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.239 -0.437 . . . . 73.310000000000002 110.909 179.841 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 60.35 31.54 74.26 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.724 -0.75 . . . . 64.540000000000006 112.494 -179.92 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 45.6 p-10 -86.24 -16.2 38.42 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.856 0.36 . . . . 75.209999999999994 110.879 -179.891 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 89.91 18.73 49.98 Favored Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.69 -0.767 . . . . 62.350000000000001 112.492 -179.975 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 14.1 m-85 -134.58 155.68 50.02 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.921 0.391 . . . . 73.120000000000005 110.912 -179.839 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 68.5 mt -122.77 121.44 63.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.136 -0.484 . . . . 72.109999999999999 111.11 179.957 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 59.7 p -114.59 176.53 5.01 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.172 -0.467 . . . . 70.349999999999994 110.872 -179.899 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . 0.532 ' HB1' ' CG1' ' A' ' 121' ' ' VAL . . . -66.08 -24.95 66.81 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.133 -0.485 . . . . 71.510000000000005 111.113 179.909 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -71.81 -49.91 34.39 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.164 -0.471 . . . . 44.439999999999998 111.108 179.949 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -76.63 -47.77 21.21 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.213 -0.449 . . . . 74.340000000000003 110.855 -179.877 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.858 HD21 ' HE2' ' A' ' 124' ' ' MET . 23.5 tp -52.95 -50.75 63.43 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.183 -0.462 . . . . 64.439999999999998 110.909 -179.974 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . 0.484 ' O ' HG23 ' A' ' 110' ' ' THR . 64.2 ttt-85 -52.32 -37.81 56.91 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.199 -0.455 . . . . 73.340000000000003 110.897 179.942 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 43.6 t60 -58.93 -34.4 71.7 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.14 -0.482 . . . . 72.239999999999995 110.873 179.982 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.551 HG11 ' CE1' ' A' ' 92' ' ' PHE . 21.7 t -74.47 -49.12 32.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.217 -0.447 . . . . 71.010000000000005 111.123 179.955 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 109' ' ' MET . . . . . 0.758 ' HA ' HD12 ' A' ' 112' ' ' LEU . 3.9 mmt -64.91 -27.16 68.66 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.185 -0.461 . . . . 74.420000000000002 110.894 179.921 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . 0.484 HG23 ' O ' ' A' ' 106' ' ' ARG . 18.9 p -75.32 -48.3 23.77 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.238 -0.437 . . . . 71.430000000000007 111.164 -179.944 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 12.2 t30 -56.61 -26.62 56.13 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.241 -0.436 . . . . 75.310000000000002 110.889 179.967 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.758 HD12 ' HA ' ' A' ' 109' ' ' MET . 6.6 mt -70.72 -22.52 62.43 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.184 -0.462 . . . . 72.540000000000006 110.92 179.958 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 101.09 33.09 5.06 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.771 -0.728 . . . . 50.149999999999999 112.444 179.882 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 24.7 mm-40 -122.28 109.97 15.11 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.899 0.38 . . . . 74.219999999999999 110.871 -179.89 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . 0.512 ' O ' HD23 ' A' ' 116' ' ' LEU . 28.0 tptt -65.44 137.1 57.23 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.188 -0.46 . . . . 72.430000000000007 110.874 179.99 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.583 HD22 ' HG2' ' A' ' 120' ' ' GLU . 48.2 mt -145.76 150.71 36.73 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.209 -0.45 . . . . 65.019999999999996 110.914 179.929 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . 0.714 ' O ' HG23 ' A' ' 121' ' ' VAL . 73.2 p -100.49 170.05 8.65 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.219 -0.446 . . . . 74.140000000000001 111.145 179.96 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -53.06 -44.61 67.6 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.25 -0.432 . . . . 74.319999999999993 110.845 179.891 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 -70.38 -45.44 66.04 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.239 -0.437 . . . . 74.209999999999994 110.884 -179.891 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . 0.583 ' HG2' HD22 ' A' ' 116' ' ' LEU . 5.7 tp10 -55.08 -32.18 61.77 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.185 -0.461 . . . . 64.510000000000005 110.898 -179.948 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.714 HG23 ' O ' ' A' ' 117' ' ' THR . 73.9 t -69.59 -30.85 46.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.206 -0.452 . . . . 71.439999999999998 111.143 179.964 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -78.49 -28.52 46.36 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.12 -0.491 . . . . 72.140000000000001 110.878 179.9 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -55.74 -50.01 71.55 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.172 -0.467 . . . . 54.020000000000003 110.876 -179.867 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . 0.858 ' HE2' HD21 ' A' ' 105' ' ' LEU . 12.4 ptm -66.72 -44.31 81.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.167 -0.47 . . . . 71.420000000000002 110.929 179.911 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 28.4 mm -53.94 -35.43 28.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.216 -0.447 . . . . 63.0 111.153 179.956 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 23.0 ttp180 -66.8 -31.78 72.63 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.16 -0.473 . . . . 73.140000000000001 110.844 179.95 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 10.1 tm-20 -68.83 -40.0 79.68 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.187 -0.461 . . . . 75.420000000000002 110.857 -179.928 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.657 ' HB3' HG22 ' A' ' 136' ' ' VAL . . . -82.57 -29.6 30.17 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.178 -0.464 . . . . 63.200000000000003 111.105 179.951 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 43.3 t0 -68.39 86.91 0.29 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.23 -0.441 . . . . 73.230000000000004 110.915 179.949 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 81.3 mt -79.69 -48.42 20.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.173 -0.467 . . . . 55.329999999999998 111.16 -179.955 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 18.7 p30 -73.01 -8.6 56.45 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.157 -0.474 . . . . 72.120000000000005 110.835 179.846 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 63.49 43.05 98.72 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.739 -0.743 . . . . 43.240000000000002 112.517 -179.915 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 25.8 p-10 -89.53 -15.8 32.13 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.868 0.366 . . . . 65.329999999999998 110.856 -179.909 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 102.96 3.51 48.73 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.723 -0.751 . . . . 70.200000000000003 112.484 179.993 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -149.14 172.11 15.34 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.852 0.358 . . . . 72.340000000000003 110.905 -179.84 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 136' ' ' VAL . . . . . 0.657 HG22 ' HB3' ' A' ' 128' ' ' ALA . 82.7 t -107.67 109.18 27.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.211 -0.45 . . . . 61.310000000000002 111.149 179.937 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 20.8 p30 -92.04 164.76 13.49 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.183 -0.462 . . . . 74.019999999999996 110.888 -179.978 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 138' ' ' TYR . . . . . 0.614 ' O ' HG23 ' A' ' 142' ' ' VAL . 15.5 t80 -52.3 -45.73 65.66 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.172 -0.467 . . . . 73.439999999999998 110.909 -179.868 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -52.01 -40.07 60.42 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.155 -0.475 . . . . 75.239999999999995 110.864 -179.986 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 24.2 mt-10 -78.42 -48.47 15.38 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.223 -0.444 . . . . 70.109999999999999 110.856 -179.928 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 47.6 t80 -54.17 -40.55 67.59 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.123 -0.489 . . . . 74.140000000000001 110.878 -179.916 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . 0.614 HG23 ' O ' ' A' ' 138' ' ' TYR . 92.6 t -69.23 -38.77 78.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.138 -0.483 . . . . 73.519999999999996 111.145 179.981 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 50.8 tt0 -68.66 -41.23 79.63 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.153 -0.476 . . . . 73.420000000000002 110.943 -179.992 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -74.73 -51.81 13.24 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.198 -0.455 . . . . 63.119999999999997 110.857 179.979 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 32.9 tpp -51.92 -30.11 22.95 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.209 -0.451 . . . . 54.219999999999999 110.929 179.901 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 89.6 m . . . . . 0 C--N 1.329 -0.292 0 CA-C-N 116.236 -0.438 . . . . 65.25 111.133 -179.95 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' M' M ' 15' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.23 0.078 0 CA-C-O 120.798 0.332 . . . . 73.299999999999997 110.873 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' M' M ' 16' ' ' TRP . . . . . 0.401 ' CZ3' HD12 ' M' ' 19' ' ' ILE . 32.2 m95 -56.59 -28.13 59.61 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.228 -0.442 . . . . 74.219999999999999 110.887 179.947 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' M' M ' 17' ' ' GLU . . . . . . . . . . . . . 9.5 tt0 -54.04 -30.26 47.1 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.267 -0.424 . . . . 73.430000000000007 110.916 -179.992 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' M' M ' 18' ' ' LYS . . . . . 0.564 ' CD ' HD13 ' A' ' 112' ' ' LEU . 2.3 ttmp? -60.77 -25.96 66.89 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.132 -0.485 . . . . 62.43 110.878 179.969 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' M' M ' 19' ' ' ILE . . . . . 0.401 HD12 ' CZ3' ' M' ' 16' ' ' TRP . 29.4 mt -103.5 -42.06 7.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.245 -0.434 . . . . 74.349999999999994 111.161 179.866 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' M' M ' 20' ' ' ARG . . . . . . . . . . . . . 46.0 ttp180 . . . . . 0 C--N 1.329 -0.308 0 CA-C-N 116.174 -0.466 . . . . 65.450000000000003 110.839 -179.969 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' M' M ' 30' ' ' LYS . . . . . . . . . . . . . 5.4 ttmm . . . . . 0 C--O 1.231 0.121 0 CA-C-O 120.831 0.348 . . . . 53.439999999999998 110.903 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' M' M ' 31' ' ' LEU . . . . . 0.481 HD11 ' HE1' ' A' ' 71' ' ' MET . 0.8 OUTLIER -118.52 -28.93 5.58 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.195 -0.457 . . . . 64.409999999999997 110.908 179.918 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' M' M ' 32' ' ' LYS . . . . . . . . . . . . . 1.8 mttp -48.9 -44.44 40.16 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.184 -0.462 . . . . 45.229999999999997 110.875 179.823 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' M' M ' 33' ' ' HIS . . . . . . . . . . . . . 56.5 t-80 -50.26 -39.78 46.05 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.212 -0.449 . . . . 71.219999999999999 110.908 179.903 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' M' M ' 34' ' ' ILE . . . . . . . . . . . . . 29.2 mt -50.31 -39.86 17.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.182 -0.463 . . . . 72.200000000000003 111.137 179.974 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' M' M ' 35' ' ' VAL . . . . . . . . . . . . . 61.2 t -48.81 -40.71 12.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.204 -0.453 . . . . 55.299999999999997 111.096 179.844 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' M' M ' 36' ' ' TRP . . . . . . . . . . . . . 21.4 m0 -59.2 -39.74 83.57 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.214 -0.448 . . . . 74.299999999999997 110.916 -179.995 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' M' M ' 37' ' ' ALA . . . . . 0.956 ' HB3' HD13 ' A' ' 39' ' ' LEU . . . -63.21 -18.7 63.8 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.226 -0.443 . . . . 73.420000000000002 111.089 179.858 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' M' M ' 38' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -66.29 -18.03 65.11 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.259 -0.428 . . . . 75.209999999999994 110.857 -179.792 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' M' M ' 39' ' ' ARG . . . . . . . . . . . . . 12.5 ptt180 -55.62 -25.74 40.45 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.109 -0.496 . . . . 74.349999999999994 110.866 -179.946 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' M' M ' 40' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -91.3 -47.97 7.18 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.203 -0.453 . . . . 65.409999999999997 110.894 -179.931 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' M' M ' 41' ' ' LEU . . . . . 0.585 HD11 ' OG ' ' A' ' 38' ' ' SER . 10.8 mt . . . . . 0 C--N 1.328 -0.326 0 CA-C-N 116.182 -0.463 . . . . 71.049999999999997 110.88 -179.97 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 13.8 tt0 . . . . . 0 C--O 1.232 0.164 0 CA-C-O 120.776 0.322 . . . . 75.400000000000006 110.896 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 3.3 mp -65.96 -50.35 70.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.232 -0.44 . . . . 74.230000000000004 111.133 179.973 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -56.02 -25.47 44.68 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.189 -0.46 . . . . 71.450000000000003 111.12 179.812 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 14.2 tp10 -75.17 -38.39 60.91 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.206 -0.452 . . . . 72.140000000000001 110.856 -179.948 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.45 ' CB ' HD13 ' A' ' 69' ' ' LEU . 54.2 m-85 -76.28 -46.13 29.32 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.175 -0.466 . . . . 73.420000000000002 110.911 -179.908 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 7.8 ptmm? -57.25 -29.39 63.77 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.183 -0.462 . . . . 70.409999999999997 110.919 179.945 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -66.82 -37.54 84.72 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.194 -0.457 . . . . 74.040000000000006 110.889 179.939 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -67.03 -37.17 83.64 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.159 -0.473 . . . . 71.409999999999997 111.089 179.934 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 77.4 t80 -59.45 -54.31 48.14 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.227 -0.442 . . . . 64.540000000000006 110.878 -179.895 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 41.5 t -56.3 -28.13 57.77 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.118 -0.492 . . . . 71.329999999999998 110.833 -179.767 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 15.5 tp -65.5 -40.79 93.47 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.138 -0.483 . . . . 73.430000000000007 110.894 -179.985 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.55 ' HA ' HG21 ' A' ' 35' ' ' VAL . 43.1 m-85 -80.49 -24.67 39.26 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.2 -0.454 . . . . 61.210000000000001 110.858 179.973 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 9.8 t0 -79.44 98.61 6.85 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.165 -0.471 . . . . 75.0 110.849 179.998 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.68 -47.06 82.74 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.193 -0.458 . . . . 64.5 110.816 -179.966 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 24.4 p-10 -86.89 -10.21 53.89 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.246 -0.434 . . . . 72.25 110.905 179.894 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 51.41 46.23 52.63 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.728 -0.749 . . . . 75.0 112.49 -179.953 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 29.5 p-10 -88.73 -14.06 38.13 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.843 0.354 . . . . 72.549999999999997 110.89 -179.984 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 105.35 13.41 24.66 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.788 -0.72 . . . . 53.539999999999999 112.491 -179.95 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 1.4 p -154.65 142.26 19.82 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.772 0.32 . . . . 54.140000000000001 111.108 -179.872 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 25.1 mt -101.84 124.99 56.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.209 -0.45 . . . . 75.099999999999994 111.102 179.943 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.552 HG22 ' CG2' ' A' ' 62' ' ' THR . 39.5 p -110.05 174.83 5.68 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.188 -0.46 . . . . 71.239999999999995 111.141 179.929 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.737 HG22 HD12 ' A' ' 52' ' ' ILE . 61.0 p -61.07 -31.89 71.54 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.178 -0.464 . . . . 72.5 111.134 179.993 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.84 -49.93 12.11 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.224 -0.444 . . . . 71.099999999999994 110.906 179.937 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 23.3 mt-10 -61.26 -33.62 73.84 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.211 -0.45 . . . . 63.539999999999999 110.908 179.958 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.1 tt -74.24 -55.11 6.43 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.12 -0.491 . . . . 71.239999999999995 110.926 -179.994 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -52.22 -27.87 24.98 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.747 -0.74 . . . . 73.420000000000002 112.461 179.948 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 54.8 m -63.69 -59.18 4.92 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.797 0.332 . . . . 73.219999999999999 111.12 -179.861 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.55 HG21 ' HA ' ' A' ' 19' ' ' PHE . 36.3 t -52.62 -49.29 45.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.208 -0.451 . . . . 73.209999999999994 111.09 179.957 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 28.2 mtp -51.83 -35.79 45.75 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.186 -0.461 . . . . 55.43 110.907 179.904 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 24.5 ttp180 -55.73 -51.88 65.84 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.199 -0.455 . . . . 74.120000000000005 110.891 -179.942 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . 0.636 ' OG ' HD21 ' M' ' 41' ' ' LEU . 3.8 t -66.45 -28.5 68.65 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.179 -0.464 . . . . 75.120000000000005 110.87 -179.816 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.963 HD13 ' HB3' ' M' ' 37' ' ' ALA . 57.6 mt -77.14 -24.3 51.62 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.111 -0.495 . . . . 72.400000000000006 110.924 179.963 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 101.35 32.8 5.08 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.756 -0.735 . . . . 54.020000000000003 112.477 179.89 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 17.6 mm-40 -131.09 105.42 7.7 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.853 0.358 . . . . 65.010000000000005 110.897 -179.874 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 59.9 t30 -109.86 76.93 1.01 Allowed Pre-proline 0 C--N 1.33 -0.282 0 CA-C-O 121.619 0.723 . . . . 71.439999999999998 110.878 -179.948 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.83 168.01 22.88 Favored 'Trans proline' 0 C--O 1.231 0.162 0 C-N-CA 122.67 2.247 . . . . 62.32 112.315 179.965 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 76.7 p -86.95 157.53 19.47 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.209 -0.45 . . . . 72.430000000000007 111.14 -179.958 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -52.28 -39.22 60.17 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.233 -0.44 . . . . 74.340000000000003 110.88 179.984 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -72.13 -32.96 67.41 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.203 -0.453 . . . . 64.219999999999999 111.092 179.946 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 10.1 tt0 -69.7 -49.71 50.79 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.191 -0.458 . . . . 75.219999999999999 110.886 -179.916 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 34.1 mt -55.14 -43.08 73.84 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.163 -0.471 . . . . 50.530000000000001 110.885 -179.955 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 19.4 tp60 -56.42 -33.63 66.01 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.151 -0.477 . . . . 64.340000000000003 110.895 179.951 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -70.18 -37.52 75.16 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.233 -0.439 . . . . 72.299999999999997 110.863 179.988 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 39.6 mtp -65.22 -57.84 7.49 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.204 -0.453 . . . . 72.329999999999998 110.88 -179.994 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.737 HD12 HG22 ' A' ' 29' ' ' THR . 62.4 mt -57.61 -42.64 81.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.21 -0.45 . . . . 55.240000000000002 111.167 179.96 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 48.6 m-20 -59.28 -37.19 77.03 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.146 -0.479 . . . . 72.409999999999997 110.842 179.936 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -65.69 -29.87 70.48 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.209 -0.451 . . . . 73.230000000000004 110.88 -179.993 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 14.7 m -103.15 6.64 10.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.144 -0.48 . . . . 75.400000000000006 111.142 179.979 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 31.3 t0 -90.11 96.63 10.76 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.125 -0.489 . . . . 74.040000000000006 110.869 179.927 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.18 -42.0 12.61 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.184 -0.462 . . . . 70.030000000000001 111.118 179.956 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -85.02 0.01 52.9 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.234 -0.439 . . . . 43.299999999999997 110.849 179.99 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 55.03 57.98 15.81 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.754 -0.736 . . . . 74.340000000000003 112.519 -179.924 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 52.2 p-10 -114.6 -15.7 11.95 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.871 0.367 . . . . 72.439999999999998 110.92 -179.917 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 90.06 16.91 55.18 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.738 -0.744 . . . . 63.130000000000003 112.446 179.917 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . 0.552 ' CG2' HG22 ' A' ' 28' ' ' THR . 46.9 p -151.35 162.85 40.2 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.735 0.302 . . . . 73.099999999999994 111.158 -179.846 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 19.9 mt -96.94 116.99 40.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.184 -0.462 . . . . 74.140000000000001 111.124 179.921 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.4 t0 -81.12 -172.95 4.02 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.199 -0.455 . . . . 74.0 110.864 179.865 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.519 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 2.5 t80 -64.93 -58.4 12.96 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.64 0.733 . . . . 74.540000000000006 110.92 -179.932 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . 0.519 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 54.1 Cg_endo -69.76 -28.73 24.89 Favored 'Trans proline' 0 C--N 1.341 0.158 0 C-N-CA 122.681 2.254 . . . . 72.319999999999993 112.379 179.937 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 23.8 mt-10 -58.24 -45.45 87.73 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.218 -0.447 . . . . 63.340000000000003 110.88 179.992 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 13.2 t80 -71.37 -36.43 71.44 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.149 -0.478 . . . . 72.439999999999998 110.892 -179.948 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.45 HD13 ' CB ' ' A' ' 12' ' ' PHE . 15.3 tp -64.09 -53.7 45.63 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.169 -0.469 . . . . 74.040000000000006 110.922 -179.972 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 14.8 t -61.26 -29.46 69.86 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.189 -0.46 . . . . 75.219999999999999 111.153 179.94 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 5.6 tmm? -63.31 -43.83 96.72 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.223 -0.444 . . . . 74.530000000000001 110.885 179.902 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -79.49 -30.01 41.85 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.223 -0.444 . . . . 73.310000000000002 110.864 179.984 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.257 0 CA-C-N 116.238 -0.437 . . . . 71.349999999999994 111.09 179.924 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.94 HG21 HG22 ' A' ' 142' ' ' VAL . 49.8 mt . . . . . 0 N--CA 1.457 -0.106 0 CA-C-O 120.853 0.359 . . . . 74.549999999999997 111.135 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 2.2 tpm_? -70.78 -53.58 14.91 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.15 -0.477 . . . . 74.409999999999997 110.855 179.974 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.722 ' O ' HG23 ' A' ' 91' ' ' VAL . 1.6 pp20? -60.44 -39.87 89.06 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.18 -0.463 . . . . 65.450000000000003 110.894 -179.933 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -59.58 -48.51 81.39 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.148 -0.478 . . . . 51.229999999999997 111.086 179.946 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 9.1 t80 -52.08 -44.93 64.59 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.27 -0.423 . . . . 74.239999999999995 110.841 -179.87 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 6.5 tpt180 -66.38 -40.77 89.9 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.178 -0.464 . . . . 73.150000000000006 110.858 -179.91 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . 0.722 HG23 ' O ' ' A' ' 87' ' ' GLU . 92.4 t -58.4 -33.85 48.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.202 -0.454 . . . . 71.420000000000002 111.153 179.981 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 9.9 m-85 -87.52 -36.86 17.37 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.161 -0.472 . . . . 72.150000000000006 110.874 -180.0 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 17.6 t0 -61.3 96.05 0.05 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.151 -0.477 . . . . 64.239999999999995 110.847 -179.979 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 7.2 mtmp? -78.63 -52.55 8.28 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.16 -0.473 . . . . 74.209999999999994 110.924 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 32.7 p30 -75.45 -9.14 58.31 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.253 -0.431 . . . . 73.510000000000005 110.872 179.855 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 60.61 31.9 76.55 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.758 -0.734 . . . . 64.209999999999994 112.46 -179.972 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 48.6 p-10 -83.13 -16.1 48.09 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.879 0.371 . . . . 73.519999999999996 110.909 -179.931 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 86.72 18.7 57.9 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.77 -0.728 . . . . 73.510000000000005 112.489 179.99 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 6.4 m-85 -137.52 147.89 45.56 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.851 0.358 . . . . 64.109999999999999 110.942 -179.853 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 62.3 mt -112.7 112.9 42.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.117 -0.492 . . . . 74.129999999999995 111.111 179.919 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 52.0 p -107.05 -174.23 2.48 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.139 -0.482 . . . . 72.049999999999997 110.847 -179.915 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . 0.539 ' HB1' ' CG1' ' A' ' 121' ' ' VAL . . . -67.71 -32.25 72.76 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.112 -0.495 . . . . 71.209999999999994 111.086 179.927 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -69.88 -45.33 67.91 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.18 -0.464 . . . . 72.129999999999995 111.098 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 18.4 mt-10 -75.32 -51.24 13.66 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.197 -0.456 . . . . 72.030000000000001 110.89 -179.942 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 47.2 tp -53.48 -43.28 68.05 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.157 -0.474 . . . . 63.020000000000003 110.925 -179.982 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 56.1 ttp180 -56.21 -49.39 74.22 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.224 -0.444 . . . . 71.319999999999993 110.903 179.931 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 80.0 t60 -54.44 -34.92 62.36 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.21 -0.45 . . . . 75.519999999999996 110.841 -179.995 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 81.0 t -67.02 -46.2 85.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.201 -0.454 . . . . 75.0 111.16 179.93 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 109' ' ' MET . . . . . 0.415 ' HE1' ' HB2' ' M' ' 15' ' ' LYS . 3.3 mmt -69.47 -25.14 63.93 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.133 -0.485 . . . . 63.439999999999998 110.885 179.923 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 7.4 m -74.12 -56.26 5.13 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.185 -0.461 . . . . 71.099999999999994 111.132 -179.891 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 6.4 t-20 -56.75 -26.79 58.21 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.234 -0.439 . . . . 73.209999999999994 110.849 -179.984 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 19.3 mt -70.74 -22.25 62.44 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.178 -0.464 . . . . 73.340000000000003 110.914 179.987 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 101.09 33.02 5.08 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.757 -0.735 . . . . 71.420000000000002 112.467 179.859 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 24.7 tp10 -110.25 163.24 13.83 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.928 0.394 . . . . 73.120000000000005 110.901 -179.889 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . 0.493 ' O ' HD23 ' A' ' 116' ' ' LEU . 48.0 mttp -116.92 103.57 10.42 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.19 -0.459 . . . . 74.010000000000005 110.904 179.958 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.621 HD22 ' HG2' ' A' ' 120' ' ' GLU . 17.9 mt -131.25 113.22 13.55 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.183 -0.462 . . . . 73.310000000000002 110.9 179.932 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 34.3 p -72.04 172.72 9.56 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.169 -0.469 . . . . 73.439999999999998 111.133 179.951 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 69.1 m-20 -51.91 -38.14 55.13 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.184 -0.462 . . . . 73.439999999999998 110.895 179.908 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 50.4 tp10 -71.7 -35.99 70.41 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.189 -0.46 . . . . 74.140000000000001 110.891 -179.901 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . 0.621 ' HG2' HD22 ' A' ' 116' ' ' LEU . 2.0 tt0 -63.55 -40.0 95.87 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.153 -0.476 . . . . 74.310000000000002 110.872 -179.93 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.539 ' CG1' ' HB1' ' A' ' 102' ' ' ALA . 60.1 t -62.72 -43.68 98.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.179 -0.464 . . . . 72.329999999999998 111.107 -179.965 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 39.8 t0 -57.06 -55.13 38.7 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.19 -0.459 . . . . 64.150000000000006 110.851 179.906 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 10.9 tm-20 -56.25 -29.28 60.86 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.157 -0.474 . . . . 72.040000000000006 110.887 -179.893 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . 0.462 ' HE1' HD11 ' M' ' 19' ' ' ILE . 24.6 ttt -68.01 -59.95 2.87 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.146 -0.479 . . . . 64.329999999999998 110.853 -179.965 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.501 HG23 HG23 ' A' ' 136' ' ' VAL . 31.4 mm -53.98 -35.78 29.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.235 -0.439 . . . . 72.420000000000002 111.092 179.98 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 31.6 ttp180 -61.12 -31.73 71.42 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.2 -0.454 . . . . 64.420000000000002 110.914 179.949 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 11.8 tm-20 -72.23 -46.27 56.76 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.185 -0.461 . . . . 75.349999999999994 110.881 -179.943 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.642 ' HB3' HG22 ' A' ' 136' ' ' VAL . . . -73.37 -25.52 60.62 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.173 -0.467 . . . . 70.519999999999996 111.101 179.938 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 38.8 t0 -68.07 87.34 0.27 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.205 -0.452 . . . . 73.129999999999995 110.878 179.975 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 70.5 mt -79.91 -48.12 20.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.195 -0.457 . . . . 62.200000000000003 111.151 179.988 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 18.9 p30 -75.1 -8.65 57.14 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.183 -0.462 . . . . 75.430000000000007 110.847 179.869 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 63.99 45.18 94.64 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.742 -0.742 . . . . 54.130000000000003 112.522 -179.884 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 35.3 p-10 -92.21 -15.84 27.01 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.867 0.365 . . . . 74.549999999999997 110.882 -179.977 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 103.46 2.83 47.36 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.772 -0.728 . . . . 33.210000000000001 112.522 -179.931 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -149.22 172.23 15.18 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.871 0.367 . . . . 75.230000000000004 110.952 -179.926 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 136' ' ' VAL . . . . . 0.642 HG22 ' HB3' ' A' ' 128' ' ' ALA . 49.1 t -108.49 113.25 43.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.21 -0.45 . . . . 45.549999999999997 111.132 179.98 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 16.3 p30 -93.17 172.1 8.52 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.159 -0.473 . . . . 75.040000000000006 110.924 179.997 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 88.6 t80 -54.91 -47.33 74.49 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.212 -0.449 . . . . 74.430000000000007 110.962 -179.922 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 25.1 tt0 -51.96 -49.72 62.63 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.094 -0.503 . . . . 74.340000000000003 110.886 -179.979 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 14.7 mt-10 -66.46 -32.68 74.2 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.18 -0.464 . . . . 70.340000000000003 110.825 -179.88 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 37.5 t80 -66.33 -45.32 80.64 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.177 -0.465 . . . . 64.329999999999998 110.926 -179.952 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . 0.94 HG22 HG21 ' A' ' 85' ' ' ILE . 66.8 t -69.53 -39.64 78.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.101 -0.499 . . . . 64.340000000000003 111.113 179.962 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 30.6 tt0 -62.28 -57.83 9.96 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.2 -0.455 . . . . 61.25 110.856 -179.964 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 11.6 tpt -56.57 -30.73 63.48 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.256 -0.429 . . . . 72.349999999999994 110.882 179.966 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 145' ' ' MET . . . . . 0.486 ' HE1' HG22 ' M' ' 19' ' ' ILE . 5.6 ttm -75.87 -37.22 59.13 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.219 -0.446 . . . . 64.439999999999998 110.935 179.934 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 1.9 m . . . . . 0 C--N 1.33 -0.28 0 CA-C-N 116.16 -0.473 . . . . 55.240000000000002 111.158 -179.927 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' M' M ' 15' ' ' LYS . . . . . 0.415 ' HB2' ' HE1' ' A' ' 109' ' ' MET . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.119 0 CA-C-O 120.763 0.316 . . . . 73.409999999999997 110.914 . . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' M' M ' 16' ' ' TRP . . . . . 0.509 ' CZ2' ' HB2' ' A' ' 128' ' ' ALA . 6.1 m95 -58.1 -37.16 73.99 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.246 -0.434 . . . . 72.239999999999995 110.957 179.917 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' M' M ' 17' ' ' GLU . . . . . . . . . . . . . 11.9 tt0 -60.27 -22.06 62.64 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.24 -0.436 . . . . 74.049999999999997 110.911 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' M' M ' 18' ' ' LYS . . . . . . . . . . . . . 19.9 ttpp -65.31 -24.79 67.37 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.137 -0.483 . . . . 75.310000000000002 110.896 179.941 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' M' M ' 19' ' ' ILE . . . . . 0.486 HG22 ' HE1' ' A' ' 145' ' ' MET . 33.1 mt -97.09 -23.14 4.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.219 -0.446 . . . . 65.430000000000007 111.088 179.927 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' M' M ' 20' ' ' ARG . . . . . . . . . . . . . 37.1 ttp85 . . . . . 0 C--N 1.329 -0.311 0 CA-C-N 116.17 -0.468 . . . . 55.240000000000002 110.87 179.986 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' M' M ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.169 0 CA-C-O 120.806 0.336 . . . . 74.25 110.878 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' M' M ' 31' ' ' LEU . . . . . . . . . . . . . 11.8 tp -157.59 -49.89 0.07 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.259 -0.428 . . . . 65.219999999999999 110.928 179.902 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' M' M ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.43 -35.89 41.41 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.21 -0.45 . . . . 73.129999999999995 110.882 179.826 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' M' M ' 33' ' ' HIS . . . . . . . . . . . . . 13.0 t-80 -50.86 -38.72 50.96 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.189 -0.46 . . . . 44.219999999999999 110.853 179.908 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' M' M ' 34' ' ' ILE . . . . . . . . . . . . . 49.5 mm -50.03 -38.7 14.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.243 -0.435 . . . . 74.450000000000003 111.153 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' M' M ' 35' ' ' VAL . . . . . . . . . . . . . 40.9 t -50.17 -40.17 17.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.182 -0.463 . . . . 74.030000000000001 111.142 179.854 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' M' M ' 36' ' ' TRP . . . . . . . . . . . . . 20.9 m0 -59.66 -36.57 76.68 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.19 -0.459 . . . . 61.420000000000002 110.893 179.977 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' M' M ' 37' ' ' ALA . . . . . 0.963 ' HB3' HD13 ' A' ' 39' ' ' LEU . . . -63.62 -18.83 64.33 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.239 -0.437 . . . . 74.200000000000003 111.076 179.901 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' M' M ' 38' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -73.67 -17.94 61.08 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.208 -0.451 . . . . 74.310000000000002 110.858 -179.754 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' M' M ' 39' ' ' ARG . . . . . . . . . . . . . 14.2 ttt180 -55.0 -26.58 37.92 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.1 -0.5 . . . . 64.230000000000004 110.888 -179.976 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' M' M ' 40' ' ' GLU . . . . . . . . . . . . . 3.5 pt-20 -84.58 -32.21 23.91 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.166 -0.47 . . . . 74.349999999999994 110.868 -179.896 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' M' M ' 41' ' ' LEU . . . . . 0.636 HD21 ' OG ' ' A' ' 38' ' ' SER . 11.2 mt . . . . . 0 C--N 1.328 -0.367 0 CA-C-N 116.146 -0.479 . . . . 73.150000000000006 110.929 -179.985 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 47.8 tt0 . . . . . 0 C--O 1.231 0.106 0 CA-C-O 120.77 0.319 . . . . 72.310000000000002 110.922 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 52.8 mt -72.9 -40.93 60.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.183 -0.462 . . . . 63.200000000000003 111.145 179.983 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.41 -28.15 69.58 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.124 -0.489 . . . . 73.150000000000006 111.144 179.756 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 19.5 mm-40 -74.93 -52.14 11.97 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.214 -0.448 . . . . 61.130000000000003 110.88 -179.909 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 26.3 m-85 -66.89 -45.99 76.28 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.156 -0.475 . . . . 73.120000000000005 110.88 -179.919 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -52.92 -46.17 67.95 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.143 -0.48 . . . . 72.5 110.931 179.948 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -54.93 -30.84 59.54 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.188 -0.46 . . . . 73.230000000000004 110.868 -179.997 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -69.52 -45.29 69.18 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.172 -0.467 . . . . 64.049999999999997 111.08 179.933 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 85.5 t80 -54.75 -54.26 44.31 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.191 -0.459 . . . . 75.329999999999998 110.903 -179.906 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 10.6 t -61.58 -26.38 67.93 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.15 -0.477 . . . . 61.119999999999997 110.902 -179.806 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 2.9 tt -65.31 -40.03 93.23 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.104 -0.498 . . . . 72.439999999999998 110.911 -179.994 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.664 ' CD1' HG11 ' A' ' 35' ' ' VAL . 36.1 m-85 -77.6 -34.62 53.39 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.147 -0.478 . . . . 54.109999999999999 110.881 179.965 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 15.9 t0 -67.21 98.57 0.62 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.134 -0.484 . . . . 61.240000000000002 110.892 179.998 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 23.3 mmtp -72.06 -56.46 5.58 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.226 -0.443 . . . . 70.129999999999995 110.893 -179.994 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 17.1 p-10 -71.01 -10.24 59.4 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.19 -0.459 . . . . 72.010000000000005 110.877 179.859 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 51.54 71.21 0.69 Allowed Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.751 -0.738 . . . . 75.230000000000004 112.438 -179.997 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 22.7 p-10 -114.52 -15.75 11.99 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.874 0.368 . . . . 72.420000000000002 110.884 179.995 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 101.21 12.37 36.48 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.718 -0.753 . . . . 50.119999999999997 112.484 -179.926 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 1.9 p -154.66 144.47 21.62 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.743 0.306 . . . . 73.319999999999993 111.133 -179.853 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 22.2 mt -102.93 114.46 42.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.237 -0.438 . . . . 71.219999999999999 111.109 179.934 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.782 HG22 HG21 ' A' ' 62' ' ' THR . 19.2 p -102.06 174.91 5.72 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.146 -0.479 . . . . 74.329999999999998 111.172 179.945 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.473 HG22 HD12 ' A' ' 52' ' ' ILE . 69.9 p -61.0 -29.97 70.01 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.198 -0.455 . . . . 63.130000000000003 111.149 -179.979 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 32.3 mtmt -79.89 -50.12 10.93 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.258 -0.428 . . . . 71.239999999999995 110.841 179.96 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.415 ' OE1' HG23 ' A' ' 28' ' ' THR . 50.8 mt-10 -63.34 -35.91 81.95 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.234 -0.439 . . . . 73.319999999999993 110.919 179.981 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.0 tt -74.25 -52.2 13.06 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.121 -0.49 . . . . 70.439999999999998 110.927 179.983 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -52.17 -29.2 28.48 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.782 -0.723 . . . . 52.219999999999999 112.477 179.928 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 95.5 m -66.07 -58.91 4.42 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.853 0.359 . . . . 64.299999999999997 111.125 -179.828 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.664 HG11 ' CD1' ' A' ' 19' ' ' PHE . 94.2 t -54.39 -45.95 69.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.216 -0.447 . . . . 72.140000000000001 111.141 179.902 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 1.9 mmm -52.18 -38.24 57.2 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.198 -0.455 . . . . 73.209999999999994 110.858 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 3.8 tmt_? -55.55 -52.74 62.72 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.214 -0.448 . . . . 63.130000000000003 110.921 -179.95 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . 0.673 ' OG ' HD21 ' M' ' 41' ' ' LEU . 5.9 t -59.89 -29.74 68.53 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.184 -0.462 . . . . 73.120000000000005 110.889 -179.813 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 1.03 HD13 ' HB3' ' M' ' 37' ' ' ALA . 48.2 mt -80.26 -21.46 42.72 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.099 -0.5 . . . . 74.040000000000006 110.93 179.957 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 101.46 31.02 5.68 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.754 -0.736 . . . . 53.240000000000002 112.448 179.868 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -127.4 113.45 16.24 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.814 0.34 . . . . 73.530000000000001 110.917 -179.924 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 32.3 t-20 -109.87 81.22 1.95 Allowed Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.628 0.728 . . . . 73.329999999999998 110.857 -179.96 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.72 167.95 22.92 Favored 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.673 2.249 . . . . 73.510000000000005 112.395 179.887 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 20.2 p -98.44 157.46 16.2 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.239 -0.437 . . . . 63.329999999999998 111.153 -179.97 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -52.02 -45.19 64.49 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.245 -0.434 . . . . 74.540000000000006 110.834 -179.952 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.555 ' HB3' ' HB2' ' A' ' 139' ' ' GLU . . . -71.07 -31.65 68.1 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.209 -0.45 . . . . 73.310000000000002 111.124 179.914 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -66.67 -49.19 66.94 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.206 -0.452 . . . . 60.310000000000002 110.871 -179.914 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 16.3 mt -55.17 -50.65 68.77 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.142 -0.481 . . . . 73.430000000000007 110.936 -179.96 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 24.6 tp60 -60.19 -28.6 68.1 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.155 -0.475 . . . . 43.109999999999999 110.947 179.919 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 45.4 t0 -74.18 -49.8 21.97 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.19 -0.459 . . . . 71.340000000000003 110.87 -179.99 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . 0.543 ' CE ' HD13 ' M' ' 31' ' ' LEU . 15.6 ptm -66.95 -41.65 86.58 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.153 -0.476 . . . . 62.219999999999999 110.926 179.974 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.473 HD12 HG22 ' A' ' 29' ' ' THR . 96.9 mt -66.76 -37.95 80.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.204 -0.453 . . . . 74.299999999999997 111.15 179.931 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 37.9 m-20 -63.2 -24.9 68.09 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.143 -0.48 . . . . 60.340000000000003 110.842 179.982 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 15.9 mm-40 -73.09 -41.2 64.33 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.194 -0.457 . . . . 74.209999999999994 110.886 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 32.6 m -86.37 -17.5 9.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.134 -0.485 . . . . 73.340000000000003 111.138 179.991 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 39.0 t0 -66.84 94.1 0.3 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.146 -0.479 . . . . 74.549999999999997 110.825 179.978 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.3 -29.79 20.11 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.183 -0.462 . . . . 63.43 111.037 179.974 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -92.86 -0.19 57.29 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.256 -0.429 . . . . 70.150000000000006 110.874 -179.976 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 52.18 60.11 8.07 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.739 -0.743 . . . . 51.310000000000002 112.498 -179.922 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 44.8 p-10 -114.43 -15.88 12.01 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.896 0.379 . . . . 64.409999999999997 110.902 -179.911 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 96.22 8.34 57.77 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.724 -0.75 . . . . 72.209999999999994 112.436 179.947 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . 0.782 HG21 HG22 ' A' ' 28' ' ' THR . 71.9 p -150.61 175.11 12.24 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.772 0.32 . . . . 61.420000000000002 111.131 -179.853 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 19.3 mt -101.67 115.6 43.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.204 -0.453 . . . . 65.129999999999995 111.146 179.874 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 27.4 m-20 -78.46 -172.88 3.08 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.155 -0.475 . . . . 61.310000000000002 110.905 179.837 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.529 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 2.5 t80 -64.83 -58.37 13.28 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 121.632 0.73 . . . . 74.230000000000004 110.847 -179.838 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . 0.529 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 54.1 Cg_endo -69.75 -31.01 21.41 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.674 2.249 . . . . 74.310000000000002 112.34 -179.997 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 19.9 mt-10 -57.45 -41.86 81.37 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.2 -0.455 . . . . 73.519999999999996 110.863 -179.942 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 10.6 t80 -73.93 -36.07 64.65 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.174 -0.467 . . . . 73.230000000000004 110.908 -179.921 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 16.8 tp -66.68 -53.92 28.67 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.146 -0.479 . . . . 74.5 110.878 -179.986 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 15.3 t -56.21 -31.23 63.3 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.2 -0.455 . . . . 74.310000000000002 111.117 179.962 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 41.4 ttp -60.05 -50.37 73.99 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.237 -0.438 . . . . 73.439999999999998 110.848 179.95 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . 0.45 ' HE2' HG21 ' M' ' 35' ' ' VAL . 1.0 OUTLIER -52.83 -44.67 66.88 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.257 -0.429 . . . . 73.25 110.901 179.93 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.289 0 CA-C-N 116.189 -0.46 . . . . 63.530000000000001 111.104 179.937 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.817 HG21 HG22 ' A' ' 142' ' ' VAL . 32.4 mt . . . . . 0 C--O 1.231 0.109 0 CA-C-O 120.838 0.351 . . . . 62.130000000000003 111.108 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 2.3 tmt_? -56.26 -53.63 54.95 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.187 -0.461 . . . . 64.109999999999999 110.856 -179.987 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.729 ' O ' HG23 ' A' ' 91' ' ' VAL . 11.7 tm-20 -56.77 -56.08 26.06 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.173 -0.467 . . . . 72.420000000000002 110.885 -179.948 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -53.33 -50.93 63.97 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.204 -0.453 . . . . 43.130000000000003 111.113 179.921 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 5.1 t80 -61.03 -35.15 76.14 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.237 -0.438 . . . . 73.239999999999995 110.832 -179.888 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 14.8 ttt-85 -72.42 -27.48 62.36 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.136 -0.484 . . . . 64.209999999999994 110.911 -179.928 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . 0.729 HG23 ' O ' ' A' ' 87' ' ' GLU . 86.2 t -75.12 -28.02 20.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.176 -0.465 . . . . 75.120000000000005 111.14 179.98 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 8.7 m-85 -95.72 -30.34 13.79 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.152 -0.476 . . . . 74.299999999999997 110.872 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 43.7 t0 -76.68 89.41 3.36 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.168 -0.469 . . . . 72.319999999999993 110.883 179.995 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 34.0 mmtt -78.02 -48.77 15.41 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.185 -0.461 . . . . 64.109999999999999 110.929 179.982 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 9.5 p30 -72.58 -9.09 58.16 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.237 -0.438 . . . . 74.109999999999999 110.841 179.903 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 60.04 28.83 66.95 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.7 -0.762 . . . . 65.239999999999995 112.504 -179.933 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 43.8 p-10 -81.89 -16.1 51.77 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.89 0.376 . . . . 72.010000000000005 110.915 -179.885 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 82.36 18.72 65.93 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.746 -0.74 . . . . 43.119999999999997 112.5 179.966 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 19.0 m-85 -137.56 136.63 37.78 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.849 0.357 . . . . 54.030000000000001 110.917 -179.76 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 79.9 mt -106.05 124.94 61.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.141 -0.482 . . . . 72.129999999999995 111.112 179.939 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 40.2 p -116.45 176.22 5.21 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.175 -0.466 . . . . 72.310000000000002 110.883 -179.945 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -60.28 -38.88 84.95 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.12 -0.491 . . . . 65.549999999999997 111.13 179.881 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -62.42 -39.6 93.83 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.211 -0.449 . . . . 63.109999999999999 111.074 179.933 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . 0.725 ' O ' HG23 ' A' ' 108' ' ' VAL . 54.6 mt-10 -73.46 -51.56 16.76 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.207 -0.451 . . . . 73.439999999999998 110.874 -179.926 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.424 HD11 HD13 ' M' ' 19' ' ' ILE . 17.2 tp -56.2 -44.52 79.54 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.195 -0.457 . . . . 73.040000000000006 110.918 -179.955 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 27.5 ttt180 -52.59 -49.2 65.48 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.211 -0.45 . . . . 72.450000000000003 110.832 179.958 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 81.0 t60 -65.57 -34.81 79.11 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.18 -0.463 . . . . 74.319999999999993 110.86 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.725 HG23 ' O ' ' A' ' 104' ' ' GLU . 91.2 t -59.18 -52.28 62.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.229 -0.442 . . . . 55.420000000000002 111.145 179.974 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 2.2 tpt -56.16 -36.35 68.21 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.19 -0.459 . . . . 64.239999999999995 110.875 179.893 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -53.56 -35.26 60.58 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.261 -0.427 . . . . 71.040000000000006 111.129 -179.917 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 5.2 t30 -74.53 -26.57 60.06 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.197 -0.456 . . . . 74.209999999999994 110.897 -179.985 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 15.4 mt -77.73 -25.37 49.25 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.141 -0.481 . . . . 74.439999999999998 110.894 179.976 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 101.07 32.97 5.11 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.716 -0.754 . . . . 43.049999999999997 112.498 179.877 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 21.2 mm-40 -129.43 110.11 11.62 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.931 0.396 . . . . 72.340000000000003 110.85 -179.852 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . 0.426 ' O ' HD23 ' A' ' 116' ' ' LEU . 20.8 pttp -72.59 135.83 45.63 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.104 -0.498 . . . . 52.0 110.901 179.961 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.558 HD21 ' HD3' ' M' ' 15' ' ' LYS . 75.0 mt -138.23 157.57 46.02 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.259 -0.428 . . . . 62.530000000000001 110.894 179.914 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 69.6 p -107.74 163.26 13.25 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.184 -0.462 . . . . 72.540000000000006 111.146 179.959 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 14.2 m-20 -52.12 -40.87 61.96 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.219 -0.446 . . . . 53.409999999999997 110.844 179.913 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 59.7 tt0 -72.98 -33.52 65.88 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.185 -0.461 . . . . 71.430000000000007 110.898 -179.881 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . 0.497 ' HG2' HD22 ' A' ' 116' ' ' LEU . 6.1 tp10 -66.5 -44.33 82.85 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.109 -0.496 . . . . 72.040000000000006 110.904 -179.953 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 91.1 t -57.81 -31.07 39.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.152 -0.476 . . . . 63.539999999999999 111.08 -179.994 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 19.0 t0 -59.62 -45.39 92.08 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.235 -0.439 . . . . 74.140000000000001 110.859 179.928 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -55.81 -30.3 61.15 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.182 -0.463 . . . . 73.019999999999996 110.888 -179.909 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 4.3 mtt -76.01 -59.41 2.77 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.111 -0.495 . . . . 73.120000000000005 110.929 179.956 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 36.1 mm -53.99 -35.5 28.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.234 -0.439 . . . . 75.400000000000006 111.138 179.973 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 52.8 ttt85 -63.01 -31.79 73.01 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.178 -0.464 . . . . 75.25 110.875 179.944 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 31.7 tp10 -75.14 -52.44 10.99 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.164 -0.471 . . . . 72.319999999999993 110.895 -179.912 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.511 ' HB3' HG22 ' A' ' 136' ' ' VAL . . . -64.86 -34.47 78.46 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.149 -0.478 . . . . 65.420000000000002 111.119 179.889 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 48.7 t0 -68.46 86.93 0.3 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.219 -0.446 . . . . 73.420000000000002 110.861 -179.973 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 130' ' ' ILE . . . . . 0.764 HD12 ' HG2' ' A' ' 140' ' ' GLU . 7.8 mt -79.97 -46.88 22.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.184 -0.462 . . . . 75.450000000000003 111.108 -179.984 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 21.1 p30 -72.47 -8.84 57.18 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.199 -0.455 . . . . 74.510000000000005 110.908 179.836 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 63.15 44.47 97.12 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.767 -0.73 . . . . 72.25 112.476 -179.97 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 35.5 p-10 -90.67 -15.95 29.45 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.86 0.362 . . . . 60.329999999999998 110.883 -179.948 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 102.79 3.02 49.54 Favored Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 120.75 -0.738 . . . . 73.420000000000002 112.492 -179.96 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 5.3 tt0 -149.27 172.3 15.09 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.824 0.345 . . . . 75.120000000000005 110.932 -179.925 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 136' ' ' VAL . . . . . 0.511 HG22 ' HB3' ' A' ' 128' ' ' ALA . 60.0 t -112.03 109.1 27.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.236 -0.438 . . . . 54.329999999999998 111.133 179.991 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 17.2 p30 -90.52 173.04 8.29 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.205 -0.452 . . . . 74.109999999999999 110.916 179.985 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 138' ' ' TYR . . . . . 0.666 ' O ' HG23 ' A' ' 142' ' ' VAL . 55.4 t80 -58.75 -47.44 84.64 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.213 -0.449 . . . . 72.140000000000001 110.94 -179.926 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 139' ' ' GLU . . . . . 0.555 ' HB2' ' HB3' ' A' ' 46' ' ' ALA . 78.4 tt0 -51.89 -39.69 59.44 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.095 -0.502 . . . . 72.239999999999995 110.929 179.986 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 140' ' ' GLU . . . . . 0.764 ' HG2' HD12 ' A' ' 130' ' ' ILE . 89.6 mt-10 -78.09 -38.31 44.45 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.135 -0.484 . . . . 71.040000000000006 110.876 -179.938 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 51.7 t80 -63.19 -35.55 80.69 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.195 -0.457 . . . . 74.200000000000003 110.841 -179.93 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . 0.817 HG22 HG21 ' A' ' 85' ' ' ILE . 99.5 t -64.43 -44.43 97.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.149 -0.478 . . . . 75.150000000000006 111.138 -179.99 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 14.5 tt0 -74.03 -30.49 62.46 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.138 -0.483 . . . . 73.329999999999998 110.901 -179.993 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 6.9 tpt -73.1 -30.68 63.84 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.177 -0.465 . . . . 52.310000000000002 110.88 -179.999 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 145' ' ' MET . . . . . 0.518 ' HE1' HG22 ' M' ' 19' ' ' ILE . 0.0 OUTLIER -82.48 -26.22 32.8 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.241 -0.436 . . . . 73.340000000000003 110.865 179.954 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 87.3 m . . . . . 0 C--N 1.329 -0.285 0 CA-C-N 116.217 -0.447 . . . . 73.439999999999998 111.172 -179.927 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' M' M ' 15' ' ' LYS . . . . . 0.558 ' HD3' HD21 ' A' ' 116' ' ' LEU . 12.8 mttm . . . . . 0 C--O 1.231 0.112 0 CA-C-O 120.792 0.329 . . . . 65.430000000000007 110.87 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' M' M ' 16' ' ' TRP . . . . . 0.713 ' CE3' HD12 ' M' ' 19' ' ' ILE . 7.8 m95 -51.79 -46.63 64.26 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.21 -0.45 . . . . 71.409999999999997 110.906 179.957 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' M' M ' 17' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -56.17 -28.44 58.1 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.262 -0.426 . . . . 71.319999999999993 110.882 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' M' M ' 18' ' ' LYS . . . . . . . . . . . . . 6.2 ttpm? -76.7 -26.01 54.24 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.15 -0.477 . . . . 62.020000000000003 110.883 179.98 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' M' M ' 19' ' ' ILE . . . . . 0.713 HD12 ' CE3' ' M' ' 16' ' ' TRP . 76.6 mt -79.35 -22.66 12.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.259 -0.428 . . . . 71.109999999999999 111.126 179.871 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' M' M ' 20' ' ' ARG . . . . . . . . . . . . . 47.7 ttp85 . . . . . 0 C--N 1.33 -0.281 0 CA-C-N 116.188 -0.46 . . . . 74.209999999999994 110.874 179.993 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' M' M ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.134 0 CA-C-O 120.788 0.327 . . . . 64.120000000000005 110.898 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' M' M ' 31' ' ' LEU . . . . . 0.543 HD13 ' CE ' ' A' ' 51' ' ' MET . 19.6 tp -130.08 -44.33 1.16 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.24 -0.437 . . . . 62.350000000000001 110.905 179.899 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' M' M ' 32' ' ' LYS . . . . . 0.404 ' O ' HG23 ' M' ' 35' ' ' VAL . 3.2 tttt -49.15 -43.71 42.02 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.201 -0.454 . . . . 73.040000000000006 110.925 179.849 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' M' M ' 33' ' ' HIS . . . . . . . . . . . . . 11.9 t60 -50.92 -39.01 53.63 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.227 -0.442 . . . . 72.129999999999995 110.841 179.853 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' M' M ' 34' ' ' ILE . . . . . . . . . . . . . 50.3 mm -51.26 -38.18 19.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.24 -0.436 . . . . 63.399999999999999 111.151 179.994 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' M' M ' 35' ' ' VAL . . . . . 0.45 HG21 ' HE2' ' A' ' 72' ' ' MET . 44.1 t -48.88 -38.84 10.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.2 -0.454 . . . . 71.530000000000001 111.18 179.819 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' M' M ' 36' ' ' TRP . . . . . . . . . . . . . 20.1 m0 -58.46 -40.31 82.32 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.154 -0.475 . . . . 65.420000000000002 110.871 179.975 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' M' M ' 37' ' ' ALA . . . . . 1.03 ' HB3' HD13 ' A' ' 39' ' ' LEU . . . -63.89 -18.85 64.6 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.283 -0.417 . . . . 72.109999999999999 111.089 179.891 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' M' M ' 38' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -81.39 -17.79 47.76 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.215 -0.448 . . . . 75.030000000000001 110.882 -179.763 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' M' M ' 39' ' ' ARG . . . . . . . . . . . . . 20.3 ttt-85 -54.99 -26.63 38.12 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.129 -0.487 . . . . 74.099999999999994 110.906 -179.975 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' M' M ' 40' ' ' GLU . . . . . . . . . . . . . 71.9 mt-10 -87.35 -45.69 10.34 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.166 -0.47 . . . . 74.120000000000005 110.892 -179.948 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' M' M ' 41' ' ' LEU . . . . . 0.673 HD21 ' OG ' ' A' ' 38' ' ' SER . 10.7 mt . . . . . 0 C--N 1.329 -0.313 0 CA-C-N 116.153 -0.476 . . . . 70.230000000000004 110.92 179.994 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 9.1 tp-100 . . . . . 0 C--O 1.231 0.089 0 CA-C-O 120.808 0.337 . . . . 74.329999999999998 110.92 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 59.5 mt -70.84 -45.48 73.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.161 -0.472 . . . . 72.030000000000001 111.125 179.969 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -54.73 -29.01 52.43 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.168 -0.469 . . . . 72.120000000000005 111.089 179.845 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 34.7 mm-40 -74.58 -52.23 12.37 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.212 -0.449 . . . . 71.340000000000003 110.915 -179.923 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 24.5 m-85 -63.05 -46.01 89.52 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.142 -0.481 . . . . 62.420000000000002 110.871 -179.924 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 2.5 tmtm? -54.69 -34.8 62.85 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.154 -0.475 . . . . 74.140000000000001 110.889 179.97 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 49.1 tt0 -64.91 -33.32 75.75 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.2 -0.455 . . . . 61.140000000000001 110.852 -179.994 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -66.8 -41.35 87.75 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.177 -0.465 . . . . 71.120000000000005 111.106 179.945 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 88.8 t80 -61.5 -54.28 45.29 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.194 -0.457 . . . . 72.230000000000004 110.877 -179.929 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 22.6 t -57.19 -26.45 60.66 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.15 -0.477 . . . . 51.219999999999999 110.858 -179.785 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.492 HD23 ' HB3' ' M' ' 38' ' ' SER . 15.3 tp -66.85 -44.32 81.35 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.136 -0.484 . . . . 75.319999999999993 110.921 -179.955 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.693 ' CD1' HG11 ' A' ' 35' ' ' VAL . 36.8 m-85 -74.61 -30.79 61.79 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.166 -0.47 . . . . 73.200000000000003 110.876 179.924 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 17.9 t0 -72.73 98.69 2.44 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.114 -0.494 . . . . 63.43 110.878 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 19.3 mtpp -68.97 -53.3 21.41 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.147 -0.479 . . . . 65.209999999999994 110.93 179.961 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 20.8 p-10 -74.18 -10.47 59.64 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.184 -0.462 . . . . 71.5 110.856 179.876 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 50.94 43.6 49.19 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.719 -0.753 . . . . 72.430000000000007 112.504 -179.918 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 35.7 p-10 -88.04 -15.61 35.88 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.824 0.345 . . . . 54.509999999999998 110.856 -179.966 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 105.38 -11.58 47.38 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.727 -0.749 . . . . 63.130000000000003 112.511 -179.922 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 9.9 p -132.99 130.7 39.84 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.764 0.316 . . . . 72.310000000000002 111.13 -179.891 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 22.2 mt -86.6 122.7 39.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.203 -0.453 . . . . 72.409999999999997 111.168 179.898 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 81.6 p -98.28 176.94 5.53 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.199 -0.455 . . . . 73.299999999999997 111.14 179.98 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.708 HG22 HD12 ' A' ' 52' ' ' ILE . 62.4 p -65.22 -45.05 86.27 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.222 -0.445 . . . . 71.120000000000005 111.147 -179.98 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 21.2 mtmm -64.22 -42.83 96.4 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.219 -0.446 . . . . 72.219999999999999 110.858 179.91 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -67.48 -32.7 73.72 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.248 -0.433 . . . . 72.519999999999996 110.844 -179.992 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.582 HD12 ' CD2' ' A' ' 48' ' ' LEU . 1.0 OUTLIER -68.35 -44.73 74.62 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.191 -0.459 . . . . 72.530000000000001 110.934 -179.95 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -71.76 -27.87 70.06 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.722 -0.752 . . . . 52.009999999999998 112.482 179.875 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 94.5 m -63.95 -54.22 37.96 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.808 0.337 . . . . 55.210000000000001 111.211 -179.889 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.693 HG11 ' CD1' ' A' ' 19' ' ' PHE . 47.2 t -58.18 -53.29 47.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.173 -0.467 . . . . 43.420000000000002 111.138 179.882 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 2.2 mtt -52.01 -36.61 50.52 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.181 -0.463 . . . . 75.420000000000002 110.856 179.938 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 34.5 ttt-85 -54.1 -46.7 72.15 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.204 -0.453 . . . . 74.409999999999997 110.859 -179.917 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . 0.632 ' OG ' HD21 ' M' ' 41' ' ' LEU . 3.1 t -68.81 -26.2 65.06 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.201 -0.454 . . . . 74.319999999999993 110.892 -179.805 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.986 HD13 ' HB3' ' M' ' 37' ' ' ALA . 39.0 mt -82.73 -18.16 41.77 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.114 -0.494 . . . . 73.010000000000005 110.918 179.974 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 101.55 28.61 6.62 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.76 -0.733 . . . . 61.130000000000003 112.496 179.924 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 8.1 mm100 -116.7 123.26 46.79 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.801 0.334 . . . . 71.120000000000005 110.923 -179.89 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 32.5 t-20 -109.91 76.76 1.0 Allowed Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 121.638 0.732 . . . . 63.200000000000003 110.876 -179.929 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.7 168.06 22.58 Favored 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.672 2.248 . . . . 65.299999999999997 112.314 179.939 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 19.5 p -112.77 154.09 26.76 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.177 -0.465 . . . . 71.120000000000005 111.118 -179.951 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 12.3 tp10 -51.96 -38.81 57.88 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.23 -0.441 . . . . 63.200000000000003 110.831 -179.991 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.34 -31.5 64.01 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.167 -0.47 . . . . 74.310000000000002 111.05 179.974 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 21.4 tt0 -72.94 -52.7 13.57 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.246 -0.434 . . . . 73.219999999999999 110.893 -179.924 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.582 ' CD2' HD12 ' A' ' 32' ' ' LEU . 34.6 mt -56.07 -49.14 74.61 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.145 -0.48 . . . . 74.439999999999998 110.893 -179.942 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 12.8 tp60 -56.86 -29.01 62.51 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.207 -0.451 . . . . 72.5 110.923 179.909 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -75.5 -49.66 18.08 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.168 -0.469 . . . . 75.230000000000004 110.891 179.966 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 32.6 mtp -60.61 -54.84 40.54 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.211 -0.45 . . . . 63.350000000000001 110.895 179.956 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.708 HD12 HG22 ' A' ' 29' ' ' THR . 65.9 mt -53.18 -42.83 47.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.264 -0.425 . . . . 65.109999999999999 111.123 179.934 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 76.0 m-20 -71.21 -27.09 63.24 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.204 -0.453 . . . . 61.329999999999998 110.865 179.974 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 10.8 tt0 -67.89 -28.95 67.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.195 -0.457 . . . . 73.319999999999993 110.893 179.994 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.444 ' CG2' HD12 ' A' ' 63' ' ' ILE . 3.4 m -112.03 16.92 7.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.155 -0.475 . . . . 62.219999999999999 111.133 179.951 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 28.8 t0 -88.89 99.55 12.49 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.198 -0.456 . . . . 73.439999999999998 110.854 179.908 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.3 -37.72 15.76 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.148 -0.478 . . . . 73.25 111.082 179.942 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -88.66 -0.32 57.17 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.222 -0.445 . . . . 62.399999999999999 110.866 179.981 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 51.37 57.89 10.93 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.746 -0.74 . . . . 43.32 112.466 -179.963 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 48.8 p-10 -114.56 -15.73 11.97 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.884 0.373 . . . . 73.150000000000006 110.894 -179.896 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 89.84 19.22 48.48 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.777 -0.725 . . . . 53.509999999999998 112.546 179.985 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 44.3 p -148.34 168.28 23.02 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.764 0.316 . . . . 73.200000000000003 111.144 -179.885 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.489 HD11 ' HA ' ' A' ' 52' ' ' ILE . 13.3 mm -100.93 109.48 25.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.214 -0.448 . . . . 74.140000000000001 111.15 179.894 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -76.2 -173.49 2.43 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.193 -0.458 . . . . 73.530000000000001 110.848 179.902 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.524 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 2.5 t80 -64.57 -58.51 13.27 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-O 121.651 0.738 . . . . 74.329999999999998 110.861 -179.895 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . 0.524 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 54.5 Cg_endo -69.69 -30.34 22.77 Favored 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 122.699 2.266 . . . . 51.539999999999999 112.38 179.981 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 18.1 mt-10 -57.17 -40.78 77.99 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.221 -0.445 . . . . 74.25 110.847 -179.957 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 12.5 t80 -74.11 -36.1 64.2 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.143 -0.48 . . . . 72.120000000000005 110.898 -179.918 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 29.0 tp -67.28 -53.74 27.14 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.137 -0.483 . . . . 75.120000000000005 110.935 -179.942 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 12.6 t -53.13 -27.56 21.43 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.173 -0.467 . . . . 73.310000000000002 111.101 179.941 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 56.1 ttp -67.51 -42.72 82.35 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.24 -0.436 . . . . 74.310000000000002 110.891 179.919 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 2.7 mtt -79.82 -31.71 40.62 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.214 -0.448 . . . . 71.030000000000001 110.863 179.998 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.266 0 CA-C-N 116.23 -0.441 . . . . 61.130000000000003 111.103 179.877 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.743 HD13 HG13 ' A' ' 142' ' ' VAL . 58.2 mt . . . . . 0 C--O 1.231 0.109 0 CA-C-O 120.823 0.344 . . . . 73.230000000000004 111.135 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 13.5 ttt85 -61.7 -28.21 69.25 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.157 -0.474 . . . . 71.319999999999993 110.887 179.982 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.727 ' O ' HG23 ' A' ' 91' ' ' VAL . 17.5 tt0 -67.36 -58.01 5.58 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.199 -0.455 . . . . 75.030000000000001 110.886 -179.941 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . 0.449 ' HB1' ' CE2' ' A' ' 92' ' ' PHE . . . -59.52 -47.38 85.76 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.196 -0.457 . . . . 54.310000000000002 111.086 179.927 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -52.03 -43.89 63.95 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.181 -0.463 . . . . 74.530000000000001 110.866 -179.878 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 60.8 ttt180 -69.53 -32.19 70.87 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.135 -0.484 . . . . 73.239999999999995 110.899 -179.917 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . 0.727 HG23 ' O ' ' A' ' 87' ' ' GLU . 90.8 t -68.5 -27.76 37.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.172 -0.467 . . . . 64.310000000000002 111.13 179.957 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.449 ' CE2' ' HB1' ' A' ' 88' ' ' ALA . 9.1 m-85 -93.68 -33.33 13.69 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.198 -0.455 . . . . 74.519999999999996 110.904 179.994 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 25.8 t0 -64.25 96.75 0.16 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.159 -0.473 . . . . 75.209999999999994 110.874 179.965 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 7.4 tppt? -78.72 -53.21 7.38 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.16 -0.473 . . . . 73.409999999999997 110.914 -179.992 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 56.4 p-10 -72.85 -9.07 58.26 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.249 -0.432 . . . . 75.510000000000005 110.891 179.848 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 59.63 26.68 62.73 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.772 -0.727 . . . . 63.450000000000003 112.448 -179.981 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 39.3 p-10 -81.8 -16.14 51.91 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.869 0.366 . . . . 63.420000000000002 110.895 -179.864 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 88.48 18.72 54.53 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.727 -0.749 . . . . 74.299999999999997 112.441 179.946 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 19.0 m-85 -140.52 150.19 43.41 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.889 0.376 . . . . 74.310000000000002 110.944 -179.823 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 62.3 mt -120.98 133.48 67.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.111 -0.495 . . . . 53.420000000000002 111.157 179.907 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 97.8 p -114.44 177.74 4.53 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.174 -0.466 . . . . 72.540000000000006 110.897 -179.896 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . 0.679 ' O ' HG11 ' A' ' 121' ' ' VAL . . . -60.66 -34.54 74.45 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.201 -0.454 . . . . 72.099999999999994 111.081 179.927 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -71.9 -49.33 38.78 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.279 -0.419 . . . . 70.109999999999999 111.093 179.966 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 17.4 mt-10 -63.01 -46.52 87.27 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.202 -0.454 . . . . 51.409999999999997 110.893 -179.922 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 26.4 tp -52.98 -42.7 65.79 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.137 -0.483 . . . . 73.230000000000004 110.887 -179.977 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . 0.705 ' HB2' HG21 ' A' ' 121' ' ' VAL . 5.9 ttt-85 -62.13 -34.95 77.33 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.219 -0.446 . . . . 71.140000000000001 110.873 179.952 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 16.5 t60 -58.52 -34.9 71.48 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.175 -0.466 . . . . 74.439999999999998 110.871 179.998 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.591 ' O ' HD12 ' A' ' 112' ' ' LEU . 58.0 t -70.99 -39.17 74.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.242 -0.435 . . . . 64.219999999999999 111.084 -179.99 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 109' ' ' MET . . . . . 0.619 ' CB ' HD12 ' A' ' 116' ' ' LEU . 5.1 mmt -76.43 -26.67 55.73 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.229 -0.441 . . . . 75.540000000000006 110.885 179.917 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 40.4 m -71.66 -56.04 6.57 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.221 -0.445 . . . . 74.239999999999995 111.164 -179.952 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -56.09 -31.16 62.99 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.219 -0.446 . . . . 72.120000000000005 110.921 179.956 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.591 HD12 ' O ' ' A' ' 108' ' ' VAL . 3.2 mt -71.46 -25.86 62.47 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.137 -0.483 . . . . 73.439999999999998 110.931 179.982 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 100.95 33.01 5.13 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.777 -0.725 . . . . 62.229999999999997 112.508 179.933 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 29.6 tp10 -110.08 110.18 20.98 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.932 0.396 . . . . 75.230000000000004 110.875 -179.896 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 30.9 mttm -60.79 102.68 0.2 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.124 -0.489 . . . . 73.200000000000003 110.894 179.984 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.619 HD12 ' CB ' ' A' ' 109' ' ' MET . 81.1 mt -138.95 146.76 41.39 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.222 -0.445 . . . . 52.25 110.937 179.893 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . 0.611 ' O ' HG23 ' A' ' 121' ' ' VAL . 41.8 p -112.62 175.12 5.57 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.185 -0.461 . . . . 71.409999999999997 111.131 179.934 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -57.1 -45.05 83.71 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.175 -0.466 . . . . 73.230000000000004 110.877 179.882 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 13.6 tp10 -62.55 -33.64 75.33 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.174 -0.466 . . . . 70.209999999999994 110.871 -179.898 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 18.5 tt0 -73.84 -31.4 63.18 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.184 -0.462 . . . . 75.209999999999994 110.91 -179.942 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.705 HG21 ' HB2' ' A' ' 106' ' ' ARG . 65.0 t -72.5 -30.72 35.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.135 -0.484 . . . . 61.409999999999997 111.083 -179.986 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -51.94 -47.24 64.8 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.193 -0.458 . . . . 74.430000000000007 110.86 179.928 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 13.0 tp10 -56.79 -29.51 62.75 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.201 -0.454 . . . . 73.109999999999999 110.917 -179.917 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 17.2 mtp -73.96 -59.01 2.92 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.129 -0.487 . . . . 72.400000000000006 110.898 179.973 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 35.4 mm -53.93 -35.76 28.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.211 -0.45 . . . . 74.519999999999996 111.161 179.926 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 63.8 ttt180 -65.13 -31.83 73.22 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.15 -0.477 . . . . 71.219999999999999 110.888 179.944 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -72.46 -50.2 27.82 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.158 -0.474 . . . . 73.340000000000003 110.871 -179.931 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.614 ' HB3' HG22 ' A' ' 136' ' ' VAL . . . -69.36 -34.01 73.94 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.204 -0.453 . . . . 74.319999999999993 111.064 179.961 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 50.3 t0 -68.41 86.6 0.29 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.229 -0.442 . . . . 72.430000000000007 110.818 -179.984 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 60.0 mt -79.93 -45.56 22.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.221 -0.445 . . . . 73.200000000000003 111.091 179.969 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 22.6 p30 -72.73 -8.79 57.12 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.192 -0.458 . . . . 73.329999999999998 110.827 179.928 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 62.77 43.34 99.1 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.717 -0.754 . . . . 50.329999999999998 112.512 -179.932 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 32.5 p-10 -88.69 -16.02 33.38 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.902 0.382 . . . . 53.420000000000002 110.888 -179.944 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 103.37 2.94 47.67 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.691 -0.766 . . . . 34.030000000000001 112.482 -179.936 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 5.1 tt0 -149.25 172.26 15.15 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.799 0.333 . . . . 71.019999999999996 110.898 -179.861 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 136' ' ' VAL . . . . . 0.614 HG22 ' HB3' ' A' ' 128' ' ' ALA . 96.1 t -109.89 118.69 57.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.181 -0.463 . . . . 74.519999999999996 111.143 179.963 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 44.2 p-10 -102.16 166.85 10.37 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.204 -0.453 . . . . 65.340000000000003 110.928 179.989 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 138' ' ' TYR . . . . . 0.704 ' O ' HG23 ' A' ' 142' ' ' VAL . 48.0 t80 -51.9 -45.62 64.26 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.206 -0.452 . . . . 72.340000000000003 110.913 -179.893 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 6.1 tm-20 -53.4 -40.61 65.19 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.122 -0.49 . . . . 74.400000000000006 110.833 -179.941 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 17.5 mt-10 -78.43 -34.5 47.82 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.154 -0.476 . . . . 74.019999999999996 110.906 -179.91 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 41.1 t80 -67.15 -35.41 79.64 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.184 -0.462 . . . . 72.319999999999993 110.856 -179.925 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . 0.743 HG13 HD13 ' A' ' 85' ' ' ILE . 97.8 t -64.67 -44.04 96.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.179 -0.464 . . . . 54.409999999999997 111.105 -179.998 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . 0.56 ' HA ' HG22 ' A' ' 146' ' ' THR . 48.6 tt0 -74.23 -23.84 59.23 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.214 -0.448 . . . . 73.230000000000004 110.88 -179.954 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 8.7 tpt -74.99 -18.85 60.3 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.169 -0.469 . . . . 71.120000000000005 110.911 179.97 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 9.2 ttm -98.23 -30.75 12.44 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.22 -0.445 . . . . 72.420000000000002 110.884 179.971 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 146' ' ' THR . . . . . 0.56 HG22 ' HA ' ' A' ' 143' ' ' GLN . 4.7 t . . . . . 0 C--N 1.329 -0.296 0 CA-C-N 116.236 -0.438 . . . . 75.430000000000007 111.174 -179.993 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' M' M ' 15' ' ' LYS . . . . . . . . . . . . . 40.5 mttp . . . . . 0 C--O 1.231 0.122 0 CA-C-O 120.754 0.312 . . . . 62.200000000000003 110.875 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' M' M ' 16' ' ' TRP . . . . . 0.514 ' CE3' HD12 ' M' ' 19' ' ' ILE . 24.2 m95 -53.77 -34.5 59.21 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.278 -0.419 . . . . 73.140000000000001 110.926 179.964 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' M' M ' 17' ' ' GLU . . . . . . . . . . . . . 5.3 tm-20 -58.67 -25.91 63.27 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.229 -0.441 . . . . 73.010000000000005 110.884 179.997 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' M' M ' 18' ' ' LYS . . . . . 0.568 ' NZ ' HD13 ' A' ' 112' ' ' LEU . 16.0 ttpp -67.66 -26.85 66.41 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.185 -0.461 . . . . 71.519999999999996 110.91 179.951 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' M' M ' 19' ' ' ILE . . . . . 0.514 HD12 ' CE3' ' M' ' 16' ' ' TRP . 28.2 mt -92.61 -22.81 5.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.215 -0.448 . . . . 51.140000000000001 111.13 179.879 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' M' M ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.294 0 CA-C-N 116.165 -0.471 . . . . 73.129999999999995 110.856 179.983 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' M' M ' 30' ' ' LYS . . . . . . . . . . . . . 2.1 mtpp . . . . . 0 C--O 1.232 0.164 0 CA-C-O 120.755 0.312 . . . . 71.030000000000001 110.887 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' M' M ' 31' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -82.89 -21.16 34.34 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.209 -0.45 . . . . 71.239999999999995 110.902 179.93 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' M' M ' 32' ' ' LYS . . . . . 0.408 ' O ' HG23 ' M' ' 35' ' ' VAL . 25.1 ttpp -48.04 -48.61 32.99 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.198 -0.455 . . . . 73.209999999999994 110.93 179.813 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' M' M ' 33' ' ' HIS . . . . . . . . . . . . . 11.1 t-80 -52.01 -37.5 53.5 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.233 -0.439 . . . . 75.510000000000005 110.846 179.87 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' M' M ' 34' ' ' ILE . . . . . 0.413 ' CG2' HD12 ' A' ' 39' ' ' LEU . 36.3 mm -51.66 -37.19 19.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.184 -0.462 . . . . 73.150000000000006 111.108 -179.991 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' M' M ' 35' ' ' VAL . . . . . 0.408 HG23 ' O ' ' M' ' 32' ' ' LYS . 46.3 t -49.48 -38.45 12.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.207 -0.451 . . . . 73.129999999999995 111.126 179.862 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' M' M ' 36' ' ' TRP . . . . . . . . . . . . . 16.9 m0 -58.6 -39.52 80.63 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.19 -0.459 . . . . 74.099999999999994 110.919 179.999 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' M' M ' 37' ' ' ALA . . . . . 0.986 ' HB3' HD13 ' A' ' 39' ' ' LEU . . . -63.44 -18.7 64.02 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.193 -0.458 . . . . 34.219999999999999 111.096 179.905 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' M' M ' 38' ' ' SER . . . . . 0.492 ' HB3' HD23 ' A' ' 18' ' ' LEU . 1.1 m -70.62 -18.03 62.87 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.18 -0.464 . . . . 72.219999999999999 110.908 -179.798 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' M' M ' 39' ' ' ARG . . . . . . . . . . . . . 8.7 mmm180 -61.48 -25.14 67.05 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.118 -0.492 . . . . 75.040000000000006 110.92 -179.963 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' M' M ' 40' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -85.51 -47.97 9.4 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.143 -0.48 . . . . 74.230000000000004 110.851 -179.904 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' M' M ' 41' ' ' LEU . . . . . 0.632 HD21 ' OG ' ' A' ' 38' ' ' SER . 12.0 mt . . . . . 0 C--N 1.329 -0.306 0 CA-C-N 116.191 -0.458 . . . . 74.030000000000001 110.882 -179.933 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.119 0 CA-C-O 120.876 0.37 . . . . 71.140000000000001 111.115 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 57.89 71.52 0.57 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.188 -0.46 . . . . 74.319999999999993 110.884 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 15.4 pt20 -165.33 171.63 13.27 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.125 -0.489 . . . . 72.010000000000005 110.923 -179.902 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 9.5 mt -118.2 141.6 48.33 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.221 -0.445 . . . . 55.420000000000002 110.871 -179.935 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 30.0 p -117.72 174.57 6.09 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.174 -0.466 . . . . 73.140000000000001 111.087 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 70.9 tt0 -53.33 -29.24 32.82 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.183 -0.462 . . . . 55.409999999999997 110.88 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -68.12 -41.06 82.3 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.199 -0.455 . . . . 72.439999999999998 110.85 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 35.4 tp60 -77.92 -37.79 47.0 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.146 -0.479 . . . . 74.299999999999997 110.898 -179.932 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 69.3 mt -71.72 -37.44 62.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.209 -0.45 . . . . 74.209999999999994 111.133 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -52.18 -32.92 38.4 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.158 -0.474 . . . . 32.530000000000001 111.087 179.796 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 -74.82 -52.1 12.28 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.231 -0.441 . . . . 73.510000000000005 110.893 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.556 ' CB ' HD13 ' A' ' 69' ' ' LEU . 50.1 m-85 -58.34 -46.0 87.07 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.181 -0.463 . . . . 65.299999999999997 110.843 -179.901 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.0 ttpt -54.89 -29.57 56.11 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.124 -0.489 . . . . 74.5 110.929 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -71.18 -30.76 66.82 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.198 -0.456 . . . . 52.219999999999999 110.932 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -64.96 -42.61 94.45 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.157 -0.474 . . . . 64.340000000000003 111.107 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 48.5 t80 -55.41 -54.21 46.62 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.168 -0.469 . . . . 71.549999999999997 110.898 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 36.5 t -51.99 -36.64 50.4 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.112 -0.495 . . . . 64.340000000000003 110.871 -179.812 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 17.7 tp -59.73 -41.62 91.32 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.15 -0.477 . . . . 71.409999999999997 110.897 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.412 ' CD1' HG11 ' A' ' 35' ' ' VAL . 33.9 m-85 -82.59 -25.87 32.85 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.227 -0.442 . . . . 74.310000000000002 110.852 179.982 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 11.1 t0 -86.69 98.53 11.18 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.179 -0.464 . . . . 53.119999999999997 110.89 179.962 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 70.4 mmtt -72.57 -56.85 4.71 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.166 -0.47 . . . . 73.549999999999997 110.894 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 27.1 p-10 -72.84 -10.09 59.4 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.206 -0.452 . . . . 63.140000000000001 110.835 179.922 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 52.05 49.08 50.74 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.759 -0.734 . . . . 73.5 112.465 -179.935 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 31.1 p-10 -88.53 -15.62 34.76 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.855 0.359 . . . . 55.329999999999998 110.871 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 105.31 -11.68 47.69 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.748 -0.739 . . . . 73.400000000000006 112.521 -179.912 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 49.0 p -135.21 130.69 35.66 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.75 0.31 . . . . 64.530000000000001 111.146 -179.879 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 24.7 mt -88.14 126.44 41.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.206 -0.452 . . . . 62.0 111.109 179.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.681 HG22 ' CG2' ' A' ' 62' ' ' THR . 60.4 p -110.33 176.2 5.14 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.187 -0.46 . . . . 50.32 111.143 179.962 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 21.7 p -64.12 -32.88 74.61 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.242 -0.435 . . . . 71.230000000000004 111.128 -179.964 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 43.5 mtpt -69.72 -43.53 72.16 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.204 -0.453 . . . . 65.230000000000004 110.932 179.901 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -75.21 -33.74 61.42 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.224 -0.444 . . . . 75.120000000000005 110.903 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.1 tt -74.28 -54.9 6.73 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.132 -0.485 . . . . 74.409999999999997 110.918 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -52.17 -28.53 26.56 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.739 -0.743 . . . . 73.400000000000006 112.467 179.91 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 94.9 m -70.84 -54.83 10.12 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.865 0.364 . . . . 72.439999999999998 111.17 -179.864 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.412 HG11 ' CD1' ' A' ' 19' ' ' PHE . 97.6 t -56.39 -46.67 82.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.171 -0.468 . . . . 75.209999999999994 111.122 179.9 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 31.3 mtp -55.96 -31.57 63.09 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.171 -0.468 . . . . 63.100000000000001 110.838 179.946 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 12.6 tpt180 -59.83 -53.32 59.28 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.265 -0.425 . . . . 73.0 110.863 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . 0.578 ' OG ' HD21 ' M' ' 41' ' ' LEU . 2.2 t -61.87 -26.6 68.24 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.185 -0.462 . . . . 71.319999999999993 110.869 -179.775 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 1.01 HD13 ' HB3' ' M' ' 37' ' ' ALA . 53.8 mt -77.96 -24.62 48.08 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.126 -0.488 . . . . 53.130000000000003 110.948 179.962 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 100.84 33.08 5.13 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.755 -0.736 . . . . 40.520000000000003 112.451 179.88 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 5.0 tp-100 -130.86 105.82 8.02 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.805 0.336 . . . . 72.340000000000003 110.877 -179.902 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 59.1 t30 -109.92 76.75 1.0 Allowed Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.643 0.735 . . . . 54.439999999999998 110.923 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.75 167.97 22.9 Favored 'Trans proline' 0 C--O 1.232 0.186 0 C-N-CA 122.685 2.256 . . . . 74.209999999999994 112.359 179.933 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 69.7 p -81.62 159.95 23.9 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.199 -0.455 . . . . 63.240000000000002 111.179 -179.986 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -52.06 -40.45 61.17 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.253 -0.431 . . . . 71.140000000000001 110.858 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.17 -31.48 64.25 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.194 -0.457 . . . . 75.319999999999993 111.081 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 27.1 tt0 -69.73 -45.94 67.01 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.223 -0.444 . . . . 73.040000000000006 110.891 -179.936 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 29.2 mt -55.33 -51.61 66.18 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.152 -0.476 . . . . 60.350000000000001 110.919 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 14.7 tp60 -59.7 -28.98 67.78 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.183 -0.462 . . . . 73.329999999999998 110.885 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -70.28 -49.57 48.41 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.224 -0.443 . . . . 75.299999999999997 110.871 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . 0.435 ' HE2' ' HG3' ' M' ' 30' ' ' LYS . 7.5 mtp -55.46 -52.65 62.92 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.204 -0.453 . . . . 75.310000000000002 110.863 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 62.8 mt -64.4 -37.72 80.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.257 -0.429 . . . . 63.409999999999997 111.128 179.941 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 19.4 m-20 -57.28 -41.74 80.35 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.195 -0.457 . . . . 73.319999999999993 110.912 179.907 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 16.3 mm-40 -53.13 -52.75 57.69 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.167 -0.469 . . . . 74.109999999999999 110.92 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.432 HG13 ' CE1' ' M' ' 29' ' ' TYR . 16.5 m -76.02 -19.26 15.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.155 -0.475 . . . . 75.049999999999997 111.126 179.977 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 38.8 t0 -66.86 95.98 0.39 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.165 -0.47 . . . . 45.420000000000002 110.856 179.931 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.21 -42.0 12.59 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.125 -0.488 . . . . 74.340000000000003 111.091 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -82.2 -0.15 43.76 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.245 -0.434 . . . . 62.539999999999999 110.864 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 53.62 60.86 7.67 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.763 -0.732 . . . . 71.329999999999998 112.489 -179.933 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 52.3 p-10 -114.49 -15.81 12.0 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.876 0.37 . . . . 73.150000000000006 110.889 -179.893 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 89.59 19.65 47.69 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.773 -0.727 . . . . 63.420000000000002 112.513 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . 0.681 ' CG2' HG22 ' A' ' 28' ' ' THR . 33.4 p -152.07 156.78 40.59 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.763 0.316 . . . . 62.439999999999998 111.148 -179.829 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.498 ' CD1' HD21 ' M' ' 31' ' ' LEU . 18.4 mt -93.37 111.04 24.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.209 -0.451 . . . . 74.430000000000007 111.123 179.921 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -75.72 -172.91 2.03 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.154 -0.475 . . . . 73.230000000000004 110.842 179.862 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.53 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 2.4 t80 -65.43 -58.28 12.42 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.633 0.73 . . . . 60.229999999999997 110.849 -179.855 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . 0.53 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 54.0 Cg_endo -69.7 -26.84 27.46 Favored 'Trans proline' 0 C--N 1.342 0.201 0 C-N-CA 122.64 2.227 . . . . 62.32 112.385 179.987 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 22.9 mt-10 -62.59 -39.99 95.49 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.21 -0.45 . . . . 72.439999999999998 110.872 -179.976 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 13.2 t80 -74.71 -35.71 62.7 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.14 -0.482 . . . . 72.420000000000002 110.882 -179.896 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.556 HD13 ' CB ' ' A' ' 12' ' ' PHE . 39.8 tp -70.56 -54.2 13.03 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.16 -0.473 . . . . 61.149999999999999 110.896 180.0 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 14.2 t -51.63 -30.4 21.31 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.165 -0.47 . . . . 71.540000000000006 111.176 179.938 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 37.3 ttp -59.71 -49.94 75.79 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.194 -0.457 . . . . 60.210000000000001 110.899 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . 0.496 ' HE2' HG21 ' M' ' 35' ' ' VAL . 3.1 mmt -70.83 -25.81 63.01 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.184 -0.462 . . . . 71.420000000000002 110.872 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -72.01 -34.58 68.97 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.212 -0.449 . . . . 55.140000000000001 111.132 179.902 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 19.5 ttm-85 -57.16 -24.2 52.65 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.216 -0.447 . . . . 74.340000000000003 110.85 -179.912 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.3 -28.27 27.28 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.213 -0.449 . . . . 73.310000000000002 110.907 179.967 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -51.89 -61.95 1.94 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.209 -0.45 . . . . 72.209999999999994 110.852 179.864 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 31.5 mmtp -152.19 -177.95 6.5 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.218 -0.446 . . . . 74.549999999999997 110.906 -179.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 21.7 m-20 63.29 162.34 0.1 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.241 -0.436 . . . . 75.409999999999997 110.863 179.84 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 94.6 m 60.11 85.97 0.1 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.221 -0.445 . . . . 65.219999999999999 111.148 -179.901 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -146.25 -42.58 0.2 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.209 -0.451 . . . . 65.340000000000003 110.852 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 3.8 p -52.01 -31.0 27.78 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.151 -0.477 . . . . 72.120000000000005 110.84 -179.795 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.472 ' HA ' HD12 ' A' ' 85' ' ' ILE . 1.8 tp10 -58.67 -43.3 89.84 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.129 -0.487 . . . . 75.219999999999999 110.889 -179.917 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -57.08 -42.11 80.07 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.127 -0.488 . . . . 65.299999999999997 110.883 -179.949 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 42.1 mm-40 -60.61 -26.67 67.17 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.153 -0.476 . . . . 63.409999999999997 110.903 -179.943 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.597 HD13 HG13 ' A' ' 142' ' ' VAL . 65.3 mt -73.99 -45.36 48.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.165 -0.47 . . . . 64.430000000000007 111.142 179.955 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 34.2 ttt-85 -71.24 -45.41 63.33 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.195 -0.457 . . . . 71.299999999999997 110.841 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.729 ' O ' HG23 ' A' ' 91' ' ' VAL . 10.2 tp10 -60.65 -53.77 53.38 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.222 -0.445 . . . . 74.420000000000002 110.893 -179.906 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -53.45 -47.85 69.34 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.183 -0.462 . . . . 22.120000000000001 111.088 179.896 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 3.0 t80 -52.09 -46.87 65.41 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.22 -0.446 . . . . 73.109999999999999 110.865 -179.899 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 22.5 ttm-85 -69.07 -31.71 70.66 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.154 -0.475 . . . . 71.439999999999998 110.863 -179.919 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . 0.729 HG23 ' O ' ' A' ' 87' ' ' GLU . 92.5 t -68.92 -27.34 35.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.163 -0.471 . . . . 74.519999999999996 111.121 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 17.9 m-85 -96.35 -26.59 15.31 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.183 -0.462 . . . . 73.129999999999995 110.899 179.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 29.6 t0 -69.48 94.57 0.76 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.141 -0.481 . . . . 71.530000000000001 110.913 179.922 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 9.7 ttmm -78.47 -52.82 7.97 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.223 -0.444 . . . . 74.25 110.895 -179.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 50.3 p30 -72.52 -9.14 58.2 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.176 -0.466 . . . . 71.129999999999995 110.789 179.938 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 60.17 27.64 65.43 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.77 -0.729 . . . . 75.219999999999999 112.464 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 39.6 p-10 -82.85 -16.22 48.5 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.879 0.371 . . . . 72.329999999999998 110.901 -179.942 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 86.47 18.67 58.35 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.748 -0.739 . . . . 70.349999999999994 112.473 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 12.4 m-85 -140.47 145.37 36.85 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.852 0.358 . . . . 72.420000000000002 110.929 -179.819 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 66.7 mt -111.5 127.02 68.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.119 -0.492 . . . . 75.310000000000002 111.13 179.93 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 26.4 p -117.0 174.67 5.97 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.155 -0.475 . . . . 62.210000000000001 110.853 -179.893 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -60.03 -30.02 68.9 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.15 -0.477 . . . . 61.539999999999999 111.113 179.912 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -69.93 -46.12 66.03 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.215 -0.448 . . . . 63.43 111.089 179.931 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 55.5 mt-10 -72.5 -46.61 53.89 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.218 -0.446 . . . . 74.420000000000002 110.881 -179.893 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.667 HD21 ' HE2' ' A' ' 124' ' ' MET . 44.1 tp -55.84 -46.54 78.15 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.187 -0.461 . . . . 74.120000000000005 110.951 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . 0.671 ' HB2' HG21 ' A' ' 121' ' ' VAL . 56.8 ttp85 -58.31 -33.76 69.84 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.168 -0.469 . . . . 71.439999999999998 110.9 179.886 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 79.6 t60 -72.18 -36.4 69.25 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.176 -0.465 . . . . 73.5 110.836 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 83.8 t -66.78 -40.82 86.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.2 -0.454 . . . . 74.200000000000003 111.124 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . 0.645 ' HE2' HD11 ' M' ' 19' ' ' ILE . 11.2 mmt -64.15 -27.9 69.39 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.183 -0.462 . . . . 73.430000000000007 110.883 179.91 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 1.5 m -66.08 -42.0 89.95 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.244 -0.435 . . . . 75.099999999999994 111.145 -179.923 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 33.4 t30 -58.63 -34.3 71.02 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.283 -0.417 . . . . 70.439999999999998 110.922 179.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 18.0 mt -73.25 -26.22 61.02 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.158 -0.474 . . . . 72.439999999999998 110.918 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 100.48 31.1 5.94 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.723 -0.751 . . . . 54.240000000000002 112.508 179.929 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -108.73 114.68 28.67 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.903 0.382 . . . . 74.310000000000002 110.88 -179.855 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.4 102.03 2.09 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.116 -0.493 . . . . 73.340000000000003 110.899 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.477 HD12 ' CB ' ' A' ' 109' ' ' MET . 11.1 mt -133.21 146.81 51.82 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.215 -0.448 . . . . 62.32 110.894 179.948 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . 0.541 ' O ' HG23 ' A' ' 121' ' ' VAL . 29.2 p -108.51 -175.39 2.76 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.141 -0.481 . . . . 63.039999999999999 111.115 179.949 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 72.6 m-20 -65.57 -38.91 90.92 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.169 -0.468 . . . . 73.239999999999995 110.878 179.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -65.43 -33.47 76.03 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.176 -0.465 . . . . 73.109999999999999 110.93 -179.929 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 19.0 tt0 -72.11 -49.8 33.28 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.12 -0.491 . . . . 72.530000000000001 110.905 -179.909 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.671 HG21 ' HB2' ' A' ' 106' ' ' ARG . 58.3 t -54.45 -31.16 22.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.175 -0.466 . . . . 71.219999999999999 111.131 179.937 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -51.94 -42.7 63.04 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.193 -0.458 . . . . 52.219999999999999 110.879 179.948 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 11.4 tp10 -62.94 -31.4 72.48 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.164 -0.471 . . . . 74.430000000000007 110.905 -179.909 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . 0.667 ' HE2' HD21 ' A' ' 105' ' ' LEU . 94.8 mtp -72.99 -59.47 2.69 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.098 -0.501 . . . . 74.310000000000002 110.869 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 35.9 mm -53.99 -35.59 28.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.208 -0.451 . . . . 73.439999999999998 111.146 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 39.1 ttt85 -63.33 -31.9 73.18 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.199 -0.455 . . . . 73.140000000000001 110.898 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 19.3 tp10 -74.85 -52.37 11.52 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.137 -0.483 . . . . 74.409999999999997 110.871 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.653 ' HB3' HG22 ' A' ' 136' ' ' VAL . . . -65.11 -34.43 78.38 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.185 -0.461 . . . . 35.240000000000002 111.102 179.967 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 49.4 t0 -68.4 86.77 0.29 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.167 -0.47 . . . . 75.099999999999994 110.862 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 58.0 mt -79.83 -46.23 22.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.184 -0.462 . . . . 73.219999999999999 111.085 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 21.2 p30 -72.76 -8.67 56.58 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.176 -0.465 . . . . 62.450000000000003 110.84 179.89 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 62.71 42.99 99.61 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.745 -0.741 . . . . 54.140000000000001 112.5 -179.914 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 34.8 p-10 -88.08 -15.95 34.86 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.881 0.372 . . . . 75.140000000000001 110.89 -179.976 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 104.1 2.36 45.16 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.733 -0.746 . . . . 60.049999999999997 112.496 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 5.6 tt0 -149.19 172.24 15.15 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.858 0.361 . . . . 73.439999999999998 110.906 -179.85 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 136' ' ' VAL . . . . . 0.653 HG22 ' HB3' ' A' ' 128' ' ' ALA . 94.6 t -107.51 111.31 35.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.233 -0.44 . . . . 72.219999999999999 111.125 179.935 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 44.0 p-10 -92.5 166.13 12.68 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.136 -0.484 . . . . 44.219999999999999 110.934 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . 0.609 ' O ' HG23 ' A' ' 142' ' ' VAL . 78.1 t80 -51.96 -46.72 64.89 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.203 -0.453 . . . . 75.129999999999995 110.961 -179.93 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -51.98 -41.04 61.84 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.092 -0.504 . . . . 75.349999999999994 110.913 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -78.44 -36.26 45.7 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.14 -0.482 . . . . 75.140000000000001 110.873 -179.92 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 66.0 t80 -64.67 -35.51 81.27 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.136 -0.484 . . . . 51.240000000000002 110.87 -179.938 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . 0.609 HG23 ' O ' ' A' ' 138' ' ' TYR . 94.4 t -69.77 -38.5 76.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.169 -0.468 . . . . 64.140000000000001 111.094 -179.982 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 45.0 tt0 -71.37 -36.56 71.49 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.19 -0.459 . . . . 73.200000000000003 110.926 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 5.7 tpt -72.81 -29.16 63.03 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.194 -0.457 . . . . 73.310000000000002 110.881 179.969 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -84.32 -27.91 27.45 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.24 -0.436 . . . . 74.049999999999997 110.846 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 87.6 m -86.75 -30.19 21.79 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.231 -0.44 . . . . 63.219999999999999 111.108 -179.898 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -101.1 172.71 6.84 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.225 -0.443 . . . . 65.239999999999995 111.078 179.917 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 86.0 tttt . . . . . 0 C--N 1.328 -0.337 0 CA-C-N 116.218 -0.446 . . . . 72.409999999999997 110.904 179.965 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' M' M ' 8' ' ' LEU . . . . . . . . . . . . . 4.3 mm? . . . . . 0 C--O 1.231 0.092 0 CA-C-O 120.841 0.353 . . . . 74.329999999999998 110.903 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' M' M ' 9' ' ' SER . . . . . . . . . . . . . 9.4 p -114.45 -61.57 1.73 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.167 -0.47 . . . . 64.239999999999995 110.871 -179.932 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' M' M ' 10' ' ' GLY . . . . . . . . . . . . . . . 177.58 176.25 45.47 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.744 -0.741 . . . . 54.350000000000001 112.461 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' M' M ' 11' ' ' GLY . . . . . . . . . . . . . . . 161.56 -105.23 0.25 Allowed Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.72 -0.752 . . . . 73.150000000000006 112.479 -179.895 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' M' M ' 12' ' ' GLU . . . . . . . . . . . . . 1.1 pm0 -111.15 177.9 4.51 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.864 0.364 . . . . 73.530000000000001 110.876 -179.886 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' M' M ' 13' ' ' LEU . . . . . 0.477 HD23 ' O ' ' M' ' 13' ' ' LEU . 10.1 tt -65.04 98.19 0.28 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.162 -0.472 . . . . 65.120000000000005 110.923 -179.934 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' M' M ' 14' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -103.1 25.78 9.04 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.199 -0.455 . . . . 63.049999999999997 110.854 179.87 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' M' M ' 15' ' ' LYS . . . . . . . . . . . . . 20.0 mttm -79.13 -44.51 21.84 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.197 -0.456 . . . . 74.430000000000007 110.871 179.95 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' M' M ' 16' ' ' TRP . . . . . 0.623 ' CE3' HD12 ' M' ' 19' ' ' ILE . 7.2 m95 -52.1 -45.9 65.05 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.257 -0.429 . . . . 75.450000000000003 110.931 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' M' M ' 17' ' ' GLU . . . . . . . . . . . . . 15.8 tm-20 -57.52 -27.2 62.38 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.211 -0.449 . . . . 71.25 110.897 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' M' M ' 18' ' ' LYS . . . . . . . . . . . . . 8.9 ttmm -69.93 -27.6 64.9 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.158 -0.473 . . . . 74.510000000000005 110.859 179.989 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' M' M ' 19' ' ' ILE . . . . . 0.645 HD11 ' HE2' ' A' ' 109' ' ' MET . 34.3 mt -83.09 -25.22 8.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.245 -0.434 . . . . 64.209999999999994 111.146 179.863 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' M' M ' 20' ' ' ARG . . . . . . . . . . . . . 22.7 ttp180 -71.27 -26.16 62.76 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.171 -0.468 . . . . 75.329999999999998 110.853 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' M' M ' 21' ' ' LEU . . . . . . . . . . . . . 9.9 mt 62.98 -176.83 0.15 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.223 -0.444 . . . . 72.329999999999998 110.898 -179.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' M' M ' 22' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -82.83 158.56 64.94 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.628 0.728 . . . . 62.520000000000003 110.866 179.979 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' M' M ' 23' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.71 124.06 10.73 Favored 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.718 2.278 . . . . 71.0 112.354 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' M' M ' 24' ' ' GLY . . . . . . . . . . . . . . . 146.19 138.36 3.19 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.737 -0.744 . . . . 73.109999999999999 112.462 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' M' M ' 25' ' ' GLY . . . . . . . . . . . . . . . 175.86 -169.57 42.28 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.774 -0.727 . . . . 73.310000000000002 112.512 -179.911 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' M' M ' 26' ' ' LYS . . . . . . . . . . . . . 4.6 mmmm -85.55 160.7 19.59 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.845 0.355 . . . . 61.409999999999997 110.912 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' M' M ' 27' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.99 142.03 35.51 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.241 -0.436 . . . . 65.219999999999999 110.868 179.899 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' M' M ' 28' ' ' GLN . . . . . . . . . . . . . 4.4 tm0? -166.45 135.27 2.96 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.243 -0.435 . . . . 74.430000000000007 110.923 179.933 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' M' M ' 29' ' ' TYR . . . . . 0.432 ' CE1' HG13 ' A' ' 55' ' ' VAL . 1.0 OUTLIER -97.01 158.59 15.35 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.261 -0.427 . . . . 74.519999999999996 110.941 -179.881 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' M' M ' 30' ' ' LYS . . . . . 0.435 ' HG3' ' HE2' ' A' ' 51' ' ' MET . 17.8 tptt -92.99 44.78 1.16 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.094 -0.503 . . . . 72.329999999999998 110.946 179.906 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' M' M ' 31' ' ' LEU . . . . . 0.498 HD21 ' CD1' ' A' ' 63' ' ' ILE . 18.9 tp -179.76 -39.07 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.212 -0.449 . . . . 73.310000000000002 110.896 179.912 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' M' M ' 32' ' ' LYS . . . . . . . . . . . . . 1.6 tmtt? -50.26 -40.95 49.52 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.23 -0.441 . . . . 74.409999999999997 110.907 179.849 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' M' M ' 33' ' ' HIS . . . . . . . . . . . . . 83.9 t60 -50.25 -38.68 41.99 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.23 -0.441 . . . . 51.509999999999998 110.894 179.842 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' M' M ' 34' ' ' ILE . . . . . . . . . . . . . 48.8 mm -50.13 -39.77 16.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.2 -0.455 . . . . 71.109999999999999 111.102 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' M' M ' 35' ' ' VAL . . . . . 0.496 HG21 ' HE2' ' A' ' 72' ' ' MET . 97.0 t -49.16 -40.18 13.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.228 -0.442 . . . . 74.120000000000005 111.1 179.869 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' M' M ' 36' ' ' TRP . . . . . . . . . . . . . 24.7 m0 -58.57 -39.67 80.98 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.196 -0.456 . . . . 73.299999999999997 110.906 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' M' M ' 37' ' ' ALA . . . . . 1.01 ' HB3' HD13 ' A' ' 39' ' ' LEU . . . -63.99 -18.69 64.54 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.25 -0.432 . . . . 72.319999999999993 111.095 179.864 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' M' M ' 38' ' ' SER . . . . . . . . . . . . . 1.6 m -71.94 -17.93 62.05 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.278 -0.419 . . . . 64.010000000000005 110.876 -179.808 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' M' M ' 39' ' ' ARG . . . . . . . . . . . . . 3.5 tpt180 -57.56 -25.43 59.96 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.122 -0.49 . . . . 62.420000000000002 110.885 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' M' M ' 40' ' ' GLU . . . . . . . . . . . . . 12.4 mt-10 -85.94 -48.12 9.0 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.182 -0.463 . . . . 75.329999999999998 110.897 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' M' M ' 41' ' ' LEU . . . . . 0.578 HD21 ' OG ' ' A' ' 38' ' ' SER . 9.8 mt -63.22 137.83 58.34 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.153 -0.476 . . . . 73.219999999999999 110.919 -179.941 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' M' M ' 42' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -64.32 160.11 19.57 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.188 -0.46 . . . . 73.049999999999997 110.898 179.916 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' M' M ' 43' ' ' ARG . . . . . . . . . . . . . 45.8 ttp180 . . . . . 0 C--N 1.329 -0.299 0 CA-C-N 116.088 -0.505 . . . . 73.349999999999994 110.873 -179.919 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 241' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 262' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 301' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 322' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.107 0 CA-C-O 120.788 0.328 . . . . 73.25 111.117 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 2.9 p-10 -165.48 84.49 0.36 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.24 -0.436 . . . . 73.439999999999998 110.879 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 6.9 pt20 -81.95 -172.2 3.79 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.185 -0.461 . . . . 64.310000000000002 110.886 -179.909 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 35.7 mt -87.33 131.08 34.38 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.217 -0.447 . . . . 41.130000000000003 110.92 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 77.4 p -102.74 167.78 9.67 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.16 -0.473 . . . . 70.439999999999998 111.119 179.961 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -52.18 -38.51 57.97 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.176 -0.465 . . . . 63.32 110.877 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -64.89 -32.12 73.68 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.178 -0.464 . . . . 74.540000000000006 110.866 -179.893 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 16.5 tp60 -77.62 -48.79 15.99 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.121 -0.49 . . . . 74.129999999999995 110.873 -179.905 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 72.0 mt -65.45 -47.25 87.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.201 -0.454 . . . . 75.510000000000005 111.112 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -56.23 -26.48 51.47 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.162 -0.472 . . . . 53.200000000000003 111.097 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -71.43 -44.31 65.11 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.227 -0.442 . . . . 62.130000000000003 110.882 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 26.1 m-85 -75.78 -45.9 33.69 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.207 -0.451 . . . . 73.439999999999998 110.876 -179.941 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 25.6 ttmt -55.47 -26.09 40.46 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.176 -0.466 . . . . 62.520000000000003 110.871 179.998 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 16.4 mm-40 -71.91 -40.25 68.97 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.24 -0.436 . . . . 71.340000000000003 110.889 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -60.1 -39.21 85.36 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.14 -0.482 . . . . 72.140000000000001 111.123 179.907 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 54.7 t80 -53.04 -52.02 59.86 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.193 -0.458 . . . . 75.439999999999998 110.909 -179.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 6.1 t -54.59 -30.37 54.32 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.171 -0.468 . . . . 74.150000000000006 110.852 -179.797 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.571 HD23 ' HB3' ' M' ' 38' ' ' SER . 15.5 tp -66.36 -45.04 81.49 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.089 -0.505 . . . . 74.219999999999999 110.929 179.991 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 57.3 m-85 -75.2 -26.21 58.81 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.235 -0.439 . . . . 72.200000000000003 110.896 179.898 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 12.9 t0 -78.27 98.56 5.95 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.108 -0.496 . . . . 61.340000000000003 110.884 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 1.3 tppp? -68.23 -51.97 39.33 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.178 -0.465 . . . . 54.340000000000003 110.894 -179.989 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 23.5 p-10 -79.51 -10.07 59.73 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.225 -0.443 . . . . 63.43 110.815 179.933 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 52.11 42.35 54.83 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.771 -0.728 . . . . 50.020000000000003 112.468 -179.938 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 19.6 p-10 -88.73 -15.69 34.12 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.896 0.379 . . . . 54.409999999999997 110.871 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 104.64 16.72 16.74 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.758 -0.734 . . . . 32.240000000000002 112.524 -179.955 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -154.64 130.71 10.25 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.76 0.314 . . . . 75.530000000000001 111.13 -179.834 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 29.3 mt -89.18 123.77 41.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.252 -0.431 . . . . 62.340000000000003 111.108 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.521 ' HA ' HG22 ' A' ' 62' ' ' THR . 43.5 p -98.58 -177.36 3.65 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.148 -0.478 . . . . 75.239999999999995 111.151 179.954 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.85 HG22 HD12 ' A' ' 52' ' ' ILE . 49.4 p -71.5 -39.56 70.75 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.235 -0.439 . . . . 74.140000000000001 111.171 -179.998 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 45.2 mmtt -68.9 -50.09 52.57 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.192 -0.458 . . . . 75.450000000000003 110.881 179.906 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.607 ' O ' HG23 ' A' ' 35' ' ' VAL . 32.8 mt-10 -59.19 -38.91 80.99 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.219 -0.446 . . . . 64.0 110.896 179.98 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.2 tt -74.3 -56.2 5.15 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.16 -0.473 . . . . 75.010000000000005 110.921 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -52.26 -44.42 57.83 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.748 -0.739 . . . . 74.140000000000001 112.46 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 92.4 m -56.49 -47.25 79.65 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.831 0.348 . . . . 65.019999999999996 111.165 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.607 HG23 ' O ' ' A' ' 31' ' ' GLU . 97.0 t -62.78 -51.11 76.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.197 -0.456 . . . . 73.040000000000006 111.13 179.937 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 21.4 mtp -51.91 -33.87 38.93 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.185 -0.461 . . . . 70.340000000000003 110.891 179.87 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 59.0 ttt85 -57.07 -54.59 45.01 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.271 -0.422 . . . . 70.219999999999999 110.906 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . 0.653 ' OG ' HD21 ' M' ' 41' ' ' LEU . 1.7 t -60.98 -26.22 67.41 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.196 -0.456 . . . . 41.130000000000003 110.879 -179.836 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.992 HD13 ' HB3' ' M' ' 37' ' ' ALA . 69.7 mt -79.73 -18.91 50.04 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.137 -0.483 . . . . 62.329999999999998 110.904 179.972 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 101.55 28.85 6.51 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.753 -0.737 . . . . 71.400000000000006 112.519 179.931 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 2.9 tt0 -128.69 106.5 8.98 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.776 0.322 . . . . 72.409999999999997 110.901 -179.84 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 6.0 t-20 -109.86 76.9 1.0 Allowed Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.625 0.726 . . . . 71.239999999999995 110.868 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.72 158.99 55.11 Favored 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.711 2.274 . . . . 53.219999999999999 112.361 179.903 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 66.4 p -76.61 160.19 29.63 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.217 -0.447 . . . . 73.510000000000005 111.159 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 7.9 mt-10 -51.97 -39.52 59.45 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.172 -0.467 . . . . 73.140000000000001 110.933 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.26 -31.57 64.17 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.126 -0.488 . . . . 72.540000000000006 111.111 179.895 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 59.8 tt0 -69.71 -47.94 61.33 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.187 -0.461 . . . . 72.549999999999997 110.919 -179.941 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 29.3 mt -55.34 -51.84 65.47 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.126 -0.488 . . . . 74.340000000000003 110.892 -179.961 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 41.4 tp60 -60.05 -28.99 68.23 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.255 -0.43 . . . . 51.049999999999997 110.955 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 39.3 t0 -67.13 -46.61 73.59 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.161 -0.472 . . . . 63.420000000000002 110.853 179.926 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . 0.583 ' HB3' HD22 ' M' ' 31' ' ' LEU . 10.9 mtp -58.72 -58.03 10.37 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.215 -0.448 . . . . 71.510000000000005 110.872 179.99 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.85 HD12 HG22 ' A' ' 29' ' ' THR . 74.1 mt -56.53 -37.56 52.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.224 -0.444 . . . . 74.420000000000002 111.148 179.976 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 63.9 m-20 -69.74 -34.63 74.11 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.17 -0.468 . . . . 64.299999999999997 110.883 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 25.5 mt-10 -61.57 -30.92 70.97 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.168 -0.469 . . . . 71.25 110.912 179.973 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.422 HG13 ' CE1' ' M' ' 29' ' ' TYR . 6.5 m -109.17 17.99 6.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.144 -0.48 . . . . 70.510000000000005 111.121 179.995 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 32.3 t0 -90.11 97.25 11.08 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.176 -0.466 . . . . 72.450000000000003 110.865 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.13 -45.32 10.23 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.151 -0.477 . . . . 72.409999999999997 111.09 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 19.8 p-10 -81.85 -0.09 41.94 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.256 -0.429 . . . . 72.120000000000005 110.86 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 54.35 57.31 17.65 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.736 -0.745 . . . . 74.140000000000001 112.484 -179.943 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 48.3 p-10 -114.48 -15.71 12.01 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.877 0.37 . . . . 45.509999999999998 110.902 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 90.28 21.94 36.57 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.773 -0.727 . . . . 63.130000000000003 112.489 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . 0.521 HG22 ' HA ' ' A' ' 28' ' ' THR . 76.0 p -150.94 165.07 34.82 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.731 0.301 . . . . 54.140000000000001 111.119 -179.86 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 28.0 mt -94.61 114.44 31.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.187 -0.461 . . . . 73.430000000000007 111.099 179.891 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -78.41 -172.91 3.07 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.168 -0.469 . . . . 72.310000000000002 110.871 179.838 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.532 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 2.5 t80 -63.97 -58.4 14.75 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-O 121.672 0.748 . . . . 63.140000000000001 110.895 -179.902 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . 0.532 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 53.8 Cg_endo -69.7 -32.08 19.54 Favored 'Trans proline' 0 C--N 1.341 0.136 0 C-N-CA 122.724 2.283 . . . . 63.340000000000003 112.387 179.985 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 74.1 mt-10 -57.25 -42.67 81.94 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.166 -0.47 . . . . 63.43 110.907 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 78.7 t80 -70.83 -36.45 72.92 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.13 -0.486 . . . . 71.400000000000006 110.9 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 15.4 tp -67.53 -53.7 26.26 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.136 -0.484 . . . . 74.530000000000001 110.973 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 14.9 t -57.24 -29.43 63.78 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.16 -0.473 . . . . 74.150000000000006 111.185 179.899 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 45.8 ttp -61.15 -42.32 98.35 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.176 -0.466 . . . . 71.329999999999998 110.898 179.901 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 8.8 mtt -79.78 -45.91 17.95 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.217 -0.447 . . . . 72.140000000000001 110.918 179.939 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -53.1 -30.98 39.52 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.215 -0.448 . . . . 74.109999999999999 111.086 179.886 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.42 -27.63 64.48 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.261 -0.427 . . . . 74.25 110.873 -179.941 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.83 -32.33 70.56 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.191 -0.459 . . . . 75.109999999999999 110.878 -179.992 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 70.8 mtp -53.85 -61.68 2.15 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.232 -0.44 . . . . 64.239999999999995 110.898 179.844 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -123.61 137.54 54.72 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.239 -0.437 . . . . 75.239999999999995 110.909 179.955 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 8.3 p-10 -125.85 -171.41 2.38 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.275 -0.42 . . . . 74.120000000000005 110.832 179.907 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 1.9 m -64.96 -30.54 71.53 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.174 -0.466 . . . . 73.310000000000002 111.118 -179.904 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 33.2 m-20 -55.53 -26.17 41.56 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.262 -0.426 . . . . 55.240000000000002 110.881 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 12.5 t -52.08 -40.68 61.57 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.146 -0.479 . . . . 72.109999999999999 110.893 -179.777 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -60.89 -33.55 73.28 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.129 -0.487 . . . . 75.310000000000002 110.863 -179.954 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 12.0 tt0 -64.38 -44.49 91.18 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.18 -0.463 . . . . 73.230000000000004 110.87 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -57.7 -27.1 62.63 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.147 -0.479 . . . . 72.420000000000002 110.898 -179.935 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.62 ' CG2' HG22 ' A' ' 142' ' ' VAL . 57.8 mt -73.89 -48.9 37.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.124 -0.489 . . . . 73.329999999999998 111.091 -179.971 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 46.3 ttp180 -71.65 -28.22 63.61 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.181 -0.463 . . . . 74.239999999999995 110.897 179.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.681 ' O ' HG23 ' A' ' 91' ' ' VAL . 4.1 tp10 -71.89 -29.14 64.03 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.164 -0.471 . . . . 71.519999999999996 110.888 -179.914 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . 0.467 ' HB1' ' CE2' ' A' ' 92' ' ' PHE . . . -76.35 -35.64 58.62 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.14 -0.482 . . . . 63.409999999999997 111.096 179.949 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 3.9 t80 -56.82 -49.31 75.79 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.196 -0.456 . . . . 74.030000000000001 110.863 -179.904 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 10.5 ptm180 -62.82 -26.16 68.6 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.102 -0.499 . . . . 71.329999999999998 110.888 -179.886 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . 0.681 HG23 ' O ' ' A' ' 87' ' ' GLU . 91.8 t -74.0 -45.74 47.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.201 -0.454 . . . . 75.209999999999994 111.156 179.951 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.467 ' CE2' ' HB1' ' A' ' 88' ' ' ALA . 9.5 m-85 -75.54 -34.76 60.78 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.126 -0.488 . . . . 74.140000000000001 110.864 -179.993 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 28.5 t0 -64.52 93.05 0.09 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.175 -0.466 . . . . 63.409999999999997 110.867 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 1.5 ttmp? -78.71 -52.75 7.96 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.175 -0.466 . . . . 65.209999999999994 110.883 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 54.1 p-10 -72.71 -9.08 58.21 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.201 -0.454 . . . . 43.200000000000003 110.854 179.911 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 60.97 33.53 84.21 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.759 -0.734 . . . . 54.200000000000003 112.517 -179.943 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 40.7 p-10 -85.52 -16.22 40.22 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.876 0.37 . . . . 72.099999999999994 110.896 -179.9 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 85.87 18.63 59.37 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.732 -0.747 . . . . 60.549999999999997 112.497 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 14.5 m-85 -140.75 151.01 44.11 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.833 0.349 . . . . 53.039999999999999 110.947 -179.799 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 64.0 mt -115.82 127.24 73.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.144 -0.48 . . . . 63.009999999999998 111.172 179.877 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 89.4 p -116.62 -171.47 2.02 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.186 -0.461 . . . . 61.119999999999997 110.836 -179.87 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -68.61 -44.77 73.58 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.133 -0.485 . . . . 70.299999999999997 111.085 179.947 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -63.8 -38.01 89.51 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.223 -0.444 . . . . 62.509999999999998 111.063 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 23.6 mt-10 -76.04 -52.07 10.96 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.216 -0.447 . . . . 74.200000000000003 110.858 -179.889 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.667 HD21 ' HG2' ' A' ' 124' ' ' MET . 35.2 tp -53.37 -52.42 59.31 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.192 -0.458 . . . . 70.0 110.952 179.998 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 50.8 ttt180 -52.27 -43.48 64.41 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.187 -0.46 . . . . 75.120000000000005 110.883 179.934 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 77.6 t60 -54.27 -34.43 60.81 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.147 -0.478 . . . . 74.230000000000004 110.893 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 92.8 t -70.25 -48.28 62.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.18 -0.463 . . . . 74.230000000000004 111.133 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . 0.614 ' HG2' HD11 ' A' ' 116' ' ' LEU . 0.2 OUTLIER -64.4 -28.23 69.54 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.186 -0.461 . . . . 71.239999999999995 110.877 179.885 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 15.6 m -62.53 -30.95 71.66 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.238 -0.437 . . . . 70.219999999999999 111.145 -179.936 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -74.71 -25.34 59.06 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.258 -0.428 . . . . 72.430000000000007 110.899 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -70.63 -25.68 63.14 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.137 -0.483 . . . . 64.129999999999995 110.948 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 99.62 19.77 19.22 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.747 -0.739 . . . . 61.200000000000003 112.466 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -103.44 112.86 25.96 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.961 0.41 . . . . 72.409999999999997 110.862 -179.845 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 16.2 mtpp -65.07 124.59 22.51 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.167 -0.47 . . . . 74.140000000000001 110.86 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.614 HD11 ' HG2' ' A' ' 109' ' ' MET . 5.2 mt -138.65 160.51 39.46 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.234 -0.439 . . . . 75.319999999999993 110.883 179.909 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 34.5 p -118.87 167.61 11.55 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.161 -0.472 . . . . 63.439999999999998 111.113 179.976 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 51.8 m-20 -52.34 -35.83 51.9 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.24 -0.437 . . . . 75.200000000000003 110.882 179.915 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 84.4 tt0 -72.81 -35.34 67.31 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.18 -0.464 . . . . 64.400000000000006 110.916 -179.92 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 36.2 tp10 -64.8 -44.54 89.59 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.138 -0.483 . . . . 63.130000000000003 110.872 -179.919 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 58.3 t -57.44 -40.46 74.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.159 -0.473 . . . . 70.010000000000005 111.092 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -52.2 -49.82 63.13 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.235 -0.439 . . . . 64.219999999999999 110.83 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . 0.588 ' HG2' HD23 ' M' ' 13' ' ' LEU . 15.7 tp10 -55.8 -29.43 59.71 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.21 -0.45 . . . . 74.430000000000007 110.93 -179.947 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . 0.667 ' HG2' HD21 ' A' ' 105' ' ' LEU . 2.9 ttt -72.65 -59.87 2.51 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.149 -0.478 . . . . 65.349999999999994 110.876 -179.973 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.49 HG23 HG23 ' A' ' 136' ' ' VAL . 33.7 mm -54.25 -35.72 30.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.229 -0.441 . . . . 75.439999999999998 111.129 179.943 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 40.8 ttt180 -63.41 -31.79 73.04 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.172 -0.467 . . . . 75.239999999999995 110.869 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 12.2 tm-20 -72.85 -50.65 22.67 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.169 -0.469 . . . . 74.329999999999998 110.932 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.562 ' HB3' ' CG2' ' A' ' 136' ' ' VAL . . . -69.68 -26.83 64.56 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.145 -0.48 . . . . 44.549999999999997 111.091 179.96 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 51.2 t0 -75.04 86.49 2.34 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.241 -0.436 . . . . 73.049999999999997 110.853 179.953 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . 0.775 HD12 ' HG2' ' A' ' 140' ' ' GLU . 4.9 mt -79.89 -45.19 22.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.215 -0.448 . . . . 72.019999999999996 111.139 179.972 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 18.2 p30 -72.42 -8.9 57.46 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.206 -0.452 . . . . 60.299999999999997 110.853 179.843 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 62.64 43.95 98.24 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.705 -0.759 . . . . 64.540000000000006 112.455 -179.927 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 33.7 p-10 -89.56 -15.96 31.71 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.858 0.361 . . . . 73.150000000000006 110.839 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 101.63 3.86 52.62 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.719 -0.753 . . . . 44.039999999999999 112.526 -179.931 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 4.7 tt0 -149.2 172.23 15.17 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.796 0.332 . . . . 73.120000000000005 110.918 -179.863 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 136' ' ' VAL . . . . . 0.562 ' CG2' ' HB3' ' A' ' 128' ' ' ALA . 95.9 t -114.08 111.49 36.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.197 -0.456 . . . . 65.150000000000006 111.131 179.934 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 14.7 p30 -91.46 170.96 9.53 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.215 -0.448 . . . . 74.150000000000006 110.909 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 45.5 t80 -55.01 -47.37 74.76 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.141 -0.481 . . . . 74.040000000000006 110.953 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -52.25 -50.62 61.7 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.112 -0.494 . . . . 72.040000000000006 110.879 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . 0.775 ' HG2' HD12 ' A' ' 130' ' ' ILE . 95.6 mt-10 -66.77 -31.72 72.55 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.152 -0.476 . . . . 64.230000000000004 110.885 -179.911 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 49.8 t80 -67.61 -50.18 59.4 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.147 -0.479 . . . . 74.200000000000003 110.861 -179.946 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . 0.62 HG22 ' CG2' ' A' ' 85' ' ' ILE . 73.0 t -62.79 -38.5 81.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.172 -0.467 . . . . 75.219999999999999 111.102 -179.973 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . 0.442 ' OE1' HD13 ' A' ' 130' ' ' ILE . 64.6 tt0 -57.46 -36.71 71.8 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.183 -0.462 . . . . 73.420000000000002 110.941 179.99 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 11.5 tpt -74.3 -55.47 5.98 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.182 -0.463 . . . . 74.329999999999998 110.896 179.938 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 21.0 ttm -59.42 -22.44 61.45 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.225 -0.443 . . . . 74.120000000000005 110.865 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 94.8 m -91.05 -41.73 10.91 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.249 -0.432 . . . . 71.150000000000006 111.167 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -95.8 -75.64 0.52 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.206 -0.452 . . . . 55.329999999999998 111.153 179.842 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 116.179 -0.464 . . . . 72.519999999999996 110.889 179.968 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' M' M ' 8' ' ' LEU . . . . . . . . . . . . . 2.1 pt? . . . . . 0 C--O 1.231 0.108 0 CA-C-O 120.835 0.35 . . . . 70.239999999999995 110.944 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' M' M ' 9' ' ' SER . . . . . . . . . . . . . 3.1 m -90.62 78.19 6.29 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.206 -0.452 . . . . 51.109999999999999 110.895 -179.955 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' M' M ' 10' ' ' GLY . . . . . . . . . . . . . . . -167.62 154.3 24.34 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.755 -0.736 . . . . 75.519999999999996 112.516 -179.97 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' M' M ' 11' ' ' GLY . . . . . . . . . . . . . . . 106.8 -29.21 11.15 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.716 -0.754 . . . . 72.409999999999997 112.513 -179.9 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' M' M ' 12' ' ' GLU . . . . . . . . . . . . . 17.4 pt-20 -66.02 -174.26 0.23 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.895 0.379 . . . . 73.510000000000005 110.904 -179.922 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' M' M ' 13' ' ' LEU . . . . . 0.588 HD23 ' HG2' ' A' ' 123' ' ' GLU . 0.9 OUTLIER -87.35 75.95 9.18 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.179 -0.464 . . . . 73.010000000000005 110.924 -179.968 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' M' M ' 14' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -102.8 25.65 9.0 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.169 -0.469 . . . . 71.540000000000006 110.827 179.887 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' M' M ' 15' ' ' LYS . . . . . . . . . . . . . 4.3 mtmp? -77.48 -34.25 54.34 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.222 -0.444 . . . . 54.219999999999999 110.895 179.976 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' M' M ' 16' ' ' TRP . . . . . 0.48 ' CZ2' ' HB2' ' A' ' 128' ' ' ALA . 44.3 m95 -51.83 -30.12 22.14 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.233 -0.439 . . . . 61.439999999999998 110.92 179.891 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' M' M ' 17' ' ' GLU . . . . . . . . . . . . . 5.4 tm-20 -54.25 -39.32 66.72 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.983 0.42 . . . . 71.409999999999997 110.911 -179.984 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' M' M ' 18' ' ' LYS . . . . . . . . . . . . . 4.8 ttpm? -62.82 -23.44 67.27 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.12 -0.491 . . . . 72.049999999999997 110.887 179.93 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' M' M ' 19' ' ' ILE . . . . . 0.422 HD11 ' HE1' ' A' ' 124' ' ' MET . 21.8 mm -70.89 -34.35 55.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.209 -0.45 . . . . 65.200000000000003 111.105 179.924 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' M' M ' 20' ' ' ARG . . . . . . . . . . . . . 25.4 ttm180 -60.8 -26.63 67.43 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.192 -0.458 . . . . 71.400000000000006 110.868 179.961 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' M' M ' 21' ' ' LEU . . . . . . . . . . . . . 6.7 mt 59.4 178.06 0.08 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.186 -0.461 . . . . 65.530000000000001 110.881 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' M' M ' 22' ' ' ARG . . . . . . . . . . . . . 19.9 mtm180 -74.74 143.8 79.09 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.587 0.708 . . . . 45.039999999999999 110.83 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' M' M ' 23' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.75 -170.93 0.42 Allowed 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.649 2.233 . . . . 64.099999999999994 112.347 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' M' M ' 24' ' ' GLY . . . . . . . . . . . . . . . 144.08 117.61 1.19 Allowed Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.771 -0.728 . . . . 62.420000000000002 112.476 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' M' M ' 25' ' ' GLY . . . . . . . . . . . . . . . 157.07 155.96 7.69 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.78 -0.724 . . . . 55.240000000000002 112.529 -179.898 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' M' M ' 26' ' ' LYS . . . . . . . . . . . . . 16.2 pttm -177.71 115.16 0.08 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.812 0.339 . . . . 64.109999999999999 110.933 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' M' M ' 27' ' ' LYS . . . . . . . . . . . . . 24.5 tptt -150.13 59.77 0.97 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.215 -0.448 . . . . 73.209999999999994 110.91 179.881 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' M' M ' 28' ' ' GLN . . . . . . . . . . . . . 1.7 tm0? -173.37 162.6 4.36 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.231 -0.44 . . . . 74.430000000000007 110.882 180.0 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' M' M ' 29' ' ' TYR . . . . . 0.422 ' CE1' HG13 ' A' ' 55' ' ' VAL . 6.3 m-85 60.03 171.8 0.08 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.163 -0.471 . . . . 71.129999999999995 110.863 -179.929 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' M' M ' 30' ' ' LYS . . . . . . . . . . . . . 8.1 pttm -178.35 33.91 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.096 -0.502 . . . . 62.439999999999998 110.888 179.912 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' M' M ' 31' ' ' LEU . . . . . 0.583 HD22 ' HB3' ' A' ' 51' ' ' MET . 19.4 tp -121.92 -34.66 3.32 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.242 -0.435 . . . . 72.209999999999994 110.891 179.938 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' M' M ' 32' ' ' LYS . . . . . . . . . . . . . 4.8 pttm -51.31 -39.85 57.79 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.223 -0.444 . . . . 74.0 110.865 179.838 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' M' M ' 33' ' ' HIS . . . . . . . . . . . . . 10.4 t-160 -50.92 -36.74 40.02 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.245 -0.434 . . . . 74.239999999999995 110.848 179.91 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' M' M ' 34' ' ' ILE . . . . . . . . . . . . . 50.7 mm -50.16 -39.17 15.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.203 -0.453 . . . . 72.230000000000004 111.136 -179.961 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' M' M ' 35' ' ' VAL . . . . . . . . . . . . . 58.3 t -49.31 -39.76 13.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.161 -0.472 . . . . 74.409999999999997 111.144 179.836 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' M' M ' 36' ' ' TRP . . . . . . . . . . . . . 23.0 m0 -58.64 -39.36 80.32 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.141 -0.481 . . . . 64.239999999999995 110.931 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' M' M ' 37' ' ' ALA . . . . . 0.992 ' HB3' HD13 ' A' ' 39' ' ' LEU . . . -63.84 -18.65 64.36 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.23 -0.441 . . . . 74.239999999999995 111.05 179.935 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' M' M ' 38' ' ' SER . . . . . 0.571 ' HB3' HD23 ' A' ' 18' ' ' LEU . 0.7 OUTLIER -72.9 -18.06 61.45 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.229 -0.441 . . . . 75.439999999999998 110.853 -179.811 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' M' M ' 39' ' ' ARG . . . . . . . . . . . . . 20.0 ptt180 -57.69 -26.3 61.51 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.17 -0.468 . . . . 74.109999999999999 110.873 -179.899 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' M' M ' 40' ' ' GLU . . . . . . . . . . . . . 12.7 tp10 -85.86 -47.94 9.22 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.161 -0.472 . . . . 72.219999999999999 110.856 -179.914 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' M' M ' 41' ' ' LEU . . . . . 0.653 HD21 ' OG ' ' A' ' 38' ' ' SER . 13.3 mt -62.78 147.97 48.28 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.163 -0.471 . . . . 73.030000000000001 110.866 -179.917 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' M' M ' 42' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -121.23 35.17 4.97 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.178 -0.465 . . . . 72.340000000000003 110.856 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' M' M ' 43' ' ' ARG . . . . . . . . . . . . . 53.3 ttp85 . . . . . 0 C--N 1.329 -0.3 0 CA-C-N 116.169 -0.469 . . . . 74.299999999999997 110.877 -179.926 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 241' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 262' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 301' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 322' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.457 -0.117 0 CA-C-O 120.824 0.345 . . . . 55.329999999999998 111.088 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -69.83 154.97 41.25 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.205 -0.452 . . . . 62.210000000000001 110.896 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 20.4 mt-30 56.46 -177.25 0.05 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.204 -0.453 . . . . 73.409999999999997 110.907 -179.906 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.604 HD22 ' CD ' ' A' ' 8' ' ' GLN . 8.0 mt -122.67 157.35 32.42 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.168 -0.469 . . . . 75.219999999999999 110.933 -179.964 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 70.2 p -121.37 177.85 5.02 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.214 -0.448 . . . . 30.210000000000001 111.104 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -54.04 -29.79 45.18 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.219 -0.446 . . . . 64.319999999999993 110.895 -179.986 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -65.13 -40.86 95.05 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.148 -0.478 . . . . 64.030000000000001 110.887 -179.961 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . 0.604 ' CD ' HD22 ' A' ' 4' ' ' LEU . 18.5 tt0 -78.02 -43.15 30.27 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.162 -0.472 . . . . 60.310000000000002 110.883 -179.916 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 60.5 mt -65.56 -37.12 79.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.242 -0.435 . . . . 65.439999999999998 111.167 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -54.6 -51.83 64.1 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.176 -0.465 . . . . 72.319999999999993 111.126 179.784 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -62.34 -49.2 76.52 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.174 -0.466 . . . . 72.5 110.918 -179.959 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.534 ' HB3' HD13 ' A' ' 69' ' ' LEU . 14.2 m-85 -55.85 -45.82 78.34 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.155 -0.475 . . . . 63.530000000000001 110.849 -179.941 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 26.6 ttpt -55.46 -25.95 39.47 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.163 -0.472 . . . . 64.140000000000001 110.927 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 16.2 tt0 -75.11 -31.07 61.05 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.178 -0.465 . . . . 75.430000000000007 110.856 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -70.67 -33.41 70.91 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.14 -0.482 . . . . 61.020000000000003 111.096 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 93.9 t80 -75.56 -54.21 7.37 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.232 -0.44 . . . . 65.310000000000002 110.886 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 17.4 t -53.23 -29.56 33.21 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.134 -0.485 . . . . 52.43 110.888 -179.827 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.42 HD23 ' CB ' ' M' ' 38' ' ' SER . 16.1 tp -63.58 -41.82 98.33 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.114 -0.494 . . . . 73.129999999999995 110.873 -179.954 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.695 ' CD1' HG11 ' A' ' 35' ' ' VAL . 20.1 m-85 -77.55 -30.9 52.95 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.194 -0.457 . . . . 72.040000000000006 110.9 179.96 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 13.3 t0 -76.96 98.62 4.99 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.124 -0.489 . . . . 73.420000000000002 110.877 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 6.2 tptt -66.47 -49.93 64.99 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.186 -0.461 . . . . 72.25 110.938 179.948 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 24.7 p-10 -81.87 -10.2 59.38 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.237 -0.438 . . . . 75.030000000000001 110.852 179.878 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 51.59 44.84 54.33 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.773 -0.727 . . . . 73.310000000000002 112.427 -179.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 29.4 p-10 -88.32 -15.52 35.48 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.852 0.358 . . . . 74.230000000000004 110.897 179.989 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 105.45 -11.63 47.1 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.746 -0.74 . . . . 64.439999999999998 112.474 -179.943 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 32.8 p -130.4 130.6 44.55 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.734 0.302 . . . . 54.109999999999999 111.159 -179.831 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 24.2 mt -96.34 112.64 28.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.236 -0.438 . . . . 65.420000000000002 111.143 179.924 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.54 HG22 HG21 ' A' ' 62' ' ' THR . 21.0 p -95.57 175.52 6.52 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.199 -0.455 . . . . 63.119999999999997 111.162 179.932 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.637 HG22 HD12 ' A' ' 52' ' ' ILE . 60.4 p -60.35 -37.2 79.92 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.23 -0.441 . . . . 63.539999999999999 111.154 -179.988 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 19.9 mmmt -60.23 -50.11 74.95 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.209 -0.451 . . . . 74.439999999999998 110.932 179.857 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.672 ' O ' HG23 ' A' ' 35' ' ' VAL . 51.5 mt-10 -72.11 -32.73 67.25 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.213 -0.448 . . . . 64.200000000000003 110.876 179.986 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.535 ' O ' HD13 ' A' ' 32' ' ' LEU . 1.1 tm? -67.83 -44.48 77.12 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.145 -0.479 . . . . 60.420000000000002 110.951 179.99 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -71.7 -27.94 70.03 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.721 -0.752 . . . . 43.409999999999997 112.532 179.87 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 96.5 m -70.31 -53.64 15.95 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.867 0.365 . . . . 73.310000000000002 111.128 -179.869 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.695 HG11 ' CD1' ' A' ' 19' ' ' PHE . 46.8 t -52.53 -51.7 32.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.189 -0.459 . . . . 75.319999999999993 111.105 179.937 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . 0.569 ' HE3' HG13 ' M' ' 34' ' ' ILE . 0.0 OUTLIER -51.89 -39.41 58.99 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.174 -0.466 . . . . 74.219999999999999 110.895 179.919 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 21.7 ttt-85 -57.01 -44.67 83.05 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.241 -0.436 . . . . 73.439999999999998 110.824 -179.894 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . 0.621 ' OG ' HD11 ' M' ' 41' ' ' LEU . 1.1 p -67.49 -26.34 66.31 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.217 -0.447 . . . . 64.540000000000006 110.835 -179.74 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.966 HD13 ' HB3' ' M' ' 37' ' ' ALA . 48.7 mt -85.64 -21.39 28.44 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.084 -0.507 . . . . 70.219999999999999 110.927 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 101.44 31.14 5.64 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.736 -0.745 . . . . 73.319999999999993 112.498 179.941 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 10.6 mt-30 -119.56 122.69 42.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.777 0.322 . . . . 44.119999999999997 110.94 -179.896 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 22.7 t-20 -109.86 76.84 0.99 Allowed Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 121.627 0.727 . . . . 73.209999999999994 110.918 -179.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.541 ' HG2' HD21 ' A' ' 48' ' ' LEU . 53.9 Cg_endo -69.76 140.23 42.19 Favored 'Trans proline' 0 C--N 1.342 0.196 0 C-N-CA 122.68 2.253 . . . . 73.120000000000005 112.359 179.938 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 29.6 p -72.64 161.63 30.53 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.209 -0.45 . . . . 62.509999999999998 111.154 -179.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 67.9 tt0 -52.04 -42.9 63.47 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.22 -0.446 . . . . 72.25 110.919 179.978 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.0 -31.54 64.56 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.184 -0.462 . . . . 72.329999999999998 111.131 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 55.5 tt0 -66.22 -50.48 63.69 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.157 -0.474 . . . . 74.420000000000002 110.872 -179.915 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.541 HD21 ' HG2' ' A' ' 43' ' ' PRO . 40.5 mt -55.17 -47.12 75.62 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.153 -0.476 . . . . 75.140000000000001 110.908 -179.954 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 21.1 tp60 -66.42 -29.03 69.09 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.203 -0.453 . . . . 73.510000000000005 110.847 179.96 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 37.9 t0 -70.68 -49.57 45.88 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.26 -0.427 . . . . 74.209999999999994 110.877 179.945 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 31.8 mtp -59.54 -57.98 10.6 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.174 -0.466 . . . . 75.400000000000006 110.874 179.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.637 HD12 HG22 ' A' ' 29' ' ' THR . 61.7 mt -53.29 -43.82 51.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.181 -0.463 . . . . 73.519999999999996 111.108 179.985 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 71.7 m-20 -64.0 -38.84 92.54 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.145 -0.48 . . . . 65.420000000000002 110.906 179.952 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -60.62 -32.08 71.24 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.185 -0.462 . . . . 72.450000000000003 110.889 179.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 26.5 m -105.31 14.7 7.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.141 -0.481 . . . . 74.109999999999999 111.118 -180.0 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 31.0 t0 -90.07 100.19 13.06 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.201 -0.454 . . . . 51.219999999999999 110.874 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.23 -45.85 9.73 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.206 -0.452 . . . . 64.230000000000004 111.084 179.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 16.8 p-10 -81.67 -0.19 41.55 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.246 -0.433 . . . . 73.420000000000002 110.87 179.952 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 53.42 56.15 21.15 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.743 -0.742 . . . . 63.420000000000002 112.473 -179.978 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 52.0 p-10 -114.49 -15.71 12.01 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.858 0.361 . . . . 73.299999999999997 110.907 -179.903 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 91.73 15.59 54.26 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.743 -0.741 . . . . 71.239999999999995 112.525 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . 0.54 HG21 HG22 ' A' ' 28' ' ' THR . 40.0 p -148.01 163.75 35.9 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.776 0.322 . . . . 74.25 111.139 -179.843 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 24.2 mt -99.9 109.5 24.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.2 -0.454 . . . . 75.230000000000004 111.141 179.868 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 4.6 t0 -75.42 -172.97 1.94 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.155 -0.475 . . . . 71.049999999999997 110.831 179.863 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.53 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 2.5 t80 -65.68 -58.42 11.62 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 121.618 0.723 . . . . 74.239999999999995 110.891 -179.886 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . 0.53 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 54.1 Cg_endo -69.74 -25.5 28.65 Favored 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.667 2.245 . . . . 52.009999999999998 112.376 179.961 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 17.4 mt-10 -61.61 -43.57 98.62 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.222 -0.444 . . . . 63.329999999999998 110.871 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 21.7 t80 -71.21 -36.21 71.8 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.172 -0.467 . . . . 72.219999999999999 110.921 -179.958 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.534 HD13 ' HB3' ' A' ' 12' ' ' PHE . 21.4 tp -62.56 -53.79 49.46 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.133 -0.485 . . . . 74.239999999999995 110.901 179.989 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 9.9 t -60.48 -30.96 70.02 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.146 -0.479 . . . . 60.530000000000001 111.116 179.951 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 7.9 tmm? -61.45 -46.76 88.74 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.233 -0.439 . . . . 74.409999999999997 110.902 179.914 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -76.07 -48.57 20.32 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.216 -0.447 . . . . 75.099999999999994 110.886 179.948 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -56.26 -28.53 58.94 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.267 -0.424 . . . . 53.509999999999998 111.107 179.923 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 16.7 ttt85 -64.87 -19.27 65.8 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.189 -0.46 . . . . 72.310000000000002 110.872 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 48.2 pttt -52.52 -29.4 25.0 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.254 -0.43 . . . . 61.119999999999997 110.9 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 5.4 ptt? -115.92 19.23 15.22 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.197 -0.456 . . . . 74.120000000000005 110.884 179.864 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 1.9 tmtm? -99.21 -68.77 0.79 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.258 -0.428 . . . . 71.230000000000004 110.861 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -173.02 -176.75 1.45 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.254 -0.43 . . . . 63.229999999999997 110.892 179.928 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 1.9 m 63.67 106.61 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.212 -0.449 . . . . 70.420000000000002 111.168 -179.868 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -168.61 -38.79 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.218 -0.446 . . . . 70.099999999999994 110.892 179.902 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 14.9 t -53.14 -34.75 58.14 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.151 -0.477 . . . . 74.239999999999995 110.873 -179.78 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.42 ' HA ' HD12 ' A' ' 85' ' ' ILE . 20.2 tp10 -56.49 -26.64 54.95 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.097 -0.501 . . . . 64.329999999999998 110.864 -179.946 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 5.4 tm-20 -75.84 -47.24 26.37 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.169 -0.468 . . . . 61.329999999999998 110.913 -179.919 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 5.1 mp0 -54.58 -40.2 68.57 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.144 -0.48 . . . . 75.230000000000004 110.867 -179.903 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.422 HG21 HG22 ' A' ' 142' ' ' VAL . 67.3 mt -57.47 -36.1 52.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.142 -0.481 . . . . 75.530000000000001 111.115 -179.997 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.06 -32.03 71.22 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.195 -0.457 . . . . 74.430000000000007 110.843 179.991 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.706 ' O ' HG23 ' A' ' 91' ' ' VAL . 8.3 tm-20 -75.67 -51.67 12.24 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.177 -0.465 . . . . 71.129999999999995 110.85 -179.881 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -54.73 -50.96 67.11 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.163 -0.472 . . . . 42.509999999999998 111.069 179.957 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 22.2 t80 -53.47 -44.49 69.01 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.207 -0.451 . . . . 75.530000000000001 110.839 -179.862 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 1.6 tmm_? -66.64 -46.04 77.05 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.176 -0.465 . . . . 72.239999999999995 110.889 -179.938 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . 0.706 HG23 ' O ' ' A' ' 87' ' ' GLU . 91.6 t -54.42 -51.02 53.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.18 -0.463 . . . . 75.519999999999996 111.11 -179.994 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.575 ' CE1' HG11 ' A' ' 108' ' ' VAL . 19.6 m-85 -66.13 -27.1 67.78 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.194 -0.457 . . . . 73.140000000000001 110.866 -179.978 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 31.4 t0 -69.67 95.21 0.85 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.13 -0.487 . . . . 60.439999999999998 110.855 179.989 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 5.7 mptp? -78.42 -52.59 8.33 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.198 -0.455 . . . . 73.340000000000003 110.865 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 44.2 p30 -72.63 -9.04 58.12 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.235 -0.438 . . . . 64.040000000000006 110.902 179.867 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 59.68 27.05 63.35 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.715 -0.755 . . . . 75.340000000000003 112.509 -179.951 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 40.0 p-10 -82.06 -16.19 50.98 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.847 0.356 . . . . 73.329999999999998 110.882 -179.928 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 84.79 18.67 61.1 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.683 -0.77 . . . . 55.229999999999997 112.517 179.978 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 20.6 m-85 -140.66 135.26 31.49 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.856 0.36 . . . . 73.420000000000002 110.936 -179.787 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 66.2 mt -102.27 126.83 56.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.125 -0.489 . . . . 75.5 111.164 179.908 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 28.7 p -111.66 -174.59 2.5 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.198 -0.456 . . . . 63.420000000000002 110.844 -179.891 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . 0.601 ' O ' HG11 ' A' ' 121' ' ' VAL . . . -71.2 -34.5 70.91 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.113 -0.494 . . . . 64.109999999999999 111.116 179.915 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -71.98 -44.83 62.88 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.209 -0.45 . . . . 75.319999999999993 111.089 179.935 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -69.09 -50.13 51.01 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.229 -0.441 . . . . 73.030000000000001 110.914 -179.934 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 42.5 tp -52.94 -33.3 50.22 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.183 -0.462 . . . . 74.540000000000006 110.94 179.991 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . 0.644 ' HB2' HG21 ' A' ' 121' ' ' VAL . 58.4 ttp85 -73.74 -36.95 65.22 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.202 -0.453 . . . . 61.240000000000002 110.896 179.943 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 2.0 t60 -54.34 -38.11 65.66 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.123 -0.49 . . . . 75.129999999999995 110.892 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.575 HG11 ' CE1' ' A' ' 92' ' ' PHE . 23.3 t -69.86 -48.14 65.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.162 -0.472 . . . . 64.230000000000004 111.137 179.961 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . 0.464 ' HB3' HD12 ' A' ' 116' ' ' LEU . 2.4 mmt -59.72 -38.27 81.22 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.196 -0.456 . . . . 73.510000000000005 110.902 179.906 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 8.0 m -52.25 -43.03 64.13 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.218 -0.446 . . . . 65.329999999999998 111.176 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -68.34 -28.91 67.56 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.203 -0.453 . . . . 65.25 110.874 179.978 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.433 ' O ' HD23 ' A' ' 112' ' ' LEU . 1.1 tt -70.87 -26.12 63.11 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.207 -0.452 . . . . 63.539999999999999 110.893 179.96 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 99.81 30.57 6.38 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.712 -0.756 . . . . 52.240000000000002 112.476 179.921 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -115.87 113.39 23.28 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.892 0.377 . . . . 75.519999999999996 110.884 -179.856 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 14.9 pttp -64.19 116.24 5.79 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.187 -0.46 . . . . 73.549999999999997 110.91 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.464 HD12 ' HB3' ' A' ' 109' ' ' MET . 14.2 mt -145.25 133.36 21.5 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.231 -0.441 . . . . 75.310000000000002 110.893 179.964 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . 0.653 ' O ' HG23 ' A' ' 121' ' ' VAL . 27.8 p -107.42 -177.13 3.26 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.167 -0.469 . . . . 72.400000000000006 111.153 179.994 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -58.91 -37.78 77.43 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.264 -0.425 . . . . 75.030000000000001 110.826 179.907 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 61.5 tt0 -73.91 -33.92 64.18 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.181 -0.463 . . . . 63.530000000000001 110.86 -179.895 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . 0.41 ' HG2' HD22 ' A' ' 116' ' ' LEU . 10.4 tt0 -74.06 -37.21 64.32 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.172 -0.467 . . . . 73.0 110.874 -179.901 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.653 HG23 ' O ' ' A' ' 117' ' ' THR . 61.0 t -74.29 -31.0 27.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.137 -0.483 . . . . 74.040000000000006 111.106 179.991 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -52.01 -45.32 64.5 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.172 -0.467 . . . . 71.219999999999999 110.864 179.903 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 21.5 tp10 -56.07 -29.69 60.9 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.186 -0.461 . . . . 52.130000000000003 110.887 -179.893 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . 0.401 ' HE1' HD11 ' M' ' 19' ' ' ILE . 14.6 mtp -75.06 -57.39 3.93 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.161 -0.472 . . . . 70.450000000000003 110.823 179.985 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.444 HG13 ' HB2' ' A' ' 102' ' ' ALA . 35.8 mm -53.88 -35.65 28.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.233 -0.439 . . . . 71.409999999999997 111.151 -179.992 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 22.1 ttp85 -63.38 -31.8 73.05 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.125 -0.489 . . . . 70.319999999999993 110.861 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 20.0 tp10 -75.01 -52.41 11.15 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.21 -0.45 . . . . 70.549999999999997 110.861 -179.922 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.674 ' HB3' HG22 ' A' ' 136' ' ' VAL . . . -64.96 -34.41 78.37 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.175 -0.466 . . . . 63.109999999999999 111.106 179.952 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 49.2 t0 -68.42 86.67 0.29 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.208 -0.451 . . . . 61.130000000000003 110.888 179.96 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 58.0 mt -79.8 -46.34 22.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.218 -0.446 . . . . 63.240000000000002 111.139 179.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 21.2 p30 -72.66 -8.74 56.83 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.225 -0.443 . . . . 72.349999999999994 110.87 179.837 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 62.79 42.97 99.59 Favored Glycine 0 N--CA 1.452 -0.245 0 C-N-CA 120.738 -0.744 . . . . 40.530000000000001 112.456 -179.912 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 34.6 p-10 -88.07 -15.89 35.05 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.809 0.338 . . . . 71.439999999999998 110.879 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 104.11 2.25 45.11 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.709 -0.758 . . . . 74.299999999999997 112.514 -179.932 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 4.0 tt0 -149.14 172.24 15.13 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.852 0.358 . . . . 72.019999999999996 110.903 -179.876 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 136' ' ' VAL . . . . . 0.674 HG22 ' HB3' ' A' ' 128' ' ' ALA . 92.9 t -106.75 109.87 29.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.213 -0.449 . . . . 55.409999999999997 111.093 179.951 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 20.4 p30 -90.97 164.86 13.84 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.15 -0.477 . . . . 72.409999999999997 110.903 179.921 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . 0.603 ' O ' HG23 ' A' ' 142' ' ' VAL . 70.1 t80 -52.05 -46.72 65.19 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.135 -0.484 . . . . 72.519999999999996 110.922 -179.932 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 11.5 tm-20 -51.92 -39.98 60.02 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.148 -0.478 . . . . 70.209999999999994 110.873 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 22.5 mt-10 -78.41 -41.69 32.36 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.153 -0.476 . . . . 75.409999999999997 110.929 -179.923 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 64.6 t80 -59.29 -35.8 74.41 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.128 -0.487 . . . . 75.530000000000001 110.899 -179.957 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . 0.603 HG23 ' O ' ' A' ' 138' ' ' TYR . 91.4 t -71.28 -37.87 67.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.153 -0.476 . . . . 74.340000000000003 111.137 179.953 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 39.9 tp60 -73.94 -31.23 62.95 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.199 -0.455 . . . . 73.439999999999998 110.922 179.986 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 9.0 tpt -74.11 -56.54 4.79 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.2 -0.454 . . . . 73.140000000000001 110.877 179.948 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 12.3 ttm -61.48 -26.09 67.67 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.286 -0.415 . . . . 63.439999999999998 110.879 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 2.5 m -109.78 21.31 17.06 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.229 -0.442 . . . . 70.439999999999998 111.107 -179.87 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -51.76 115.59 1.72 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.171 -0.468 . . . . 73.140000000000001 111.103 179.823 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.289 0 CA-C-N 116.234 -0.439 . . . . 64.030000000000001 110.928 179.939 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' M' M ' 8' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.231 0.117 0 CA-C-O 120.757 0.313 . . . . 75.099999999999994 110.913 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' M' M ' 9' ' ' SER . . . . . . . . . . . . . 1.8 t 62.02 48.02 5.43 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.194 -0.457 . . . . 50.329999999999998 110.844 -179.956 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' M' M ' 10' ' ' GLY . . . . . . . . . . . . . . . -90.2 166.38 32.13 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.797 -0.716 . . . . 55.310000000000002 112.499 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' M' M ' 11' ' ' GLY . . . . . . . . . . . . . . . -69.9 173.88 37.53 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.72 -0.752 . . . . 65.409999999999997 112.491 -179.879 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' M' M ' 12' ' ' GLU . . . . . . . . . . . . . 19.9 mt-10 -112.24 -58.2 2.17 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.884 0.373 . . . . 71.519999999999996 110.932 -179.913 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' M' M ' 13' ' ' LEU . . . . . 0.752 HD22 ' HG2' ' M' ' 15' ' ' LYS . 2.5 tt -87.97 129.21 35.32 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.13 -0.487 . . . . 62.530000000000001 110.901 -179.958 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' M' M ' 14' ' ' ASP . . . . . 0.615 ' N ' HD23 ' M' ' 13' ' ' LEU . 41.4 t0 -78.64 59.27 2.44 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.222 -0.445 . . . . 61.310000000000002 110.856 179.855 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' M' M ' 15' ' ' LYS . . . . . 0.752 ' HG2' HD22 ' M' ' 13' ' ' LEU . 18.9 mttp -69.43 -42.31 75.16 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.207 -0.451 . . . . 54.520000000000003 110.871 179.982 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' M' M ' 16' ' ' TRP . . . . . 0.723 ' CE3' HD12 ' M' ' 19' ' ' ILE . 10.6 m95 -51.76 -46.91 64.26 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.247 -0.433 . . . . 75.510000000000005 110.944 179.904 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' M' M ' 17' ' ' GLU . . . . . . . . . . . . . 3.1 tm-20 -55.36 -27.1 45.09 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.189 -0.46 . . . . 75.340000000000003 110.889 -179.965 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' M' M ' 18' ' ' LYS . . . . . . . . . . . . . 8.7 ttmm -75.61 -28.93 59.05 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.127 -0.488 . . . . 74.209999999999994 110.891 179.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' M' M ' 19' ' ' ILE . . . . . 0.723 HD12 ' CE3' ' M' ' 16' ' ' TRP . 54.5 mt -78.95 -24.86 13.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.207 -0.451 . . . . 71.5 111.166 179.832 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' M' M ' 20' ' ' ARG . . . . . . . . . . . . . 48.7 ttp180 -52.01 -30.14 23.96 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.154 -0.475 . . . . 70.200000000000003 110.851 179.996 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' M' M ' 21' ' ' LEU . . . . . . . . . . . . . 6.9 mt 57.68 -175.98 0.07 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.194 -0.457 . . . . 71.010000000000005 110.908 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' M' M ' 22' ' ' ARG . . . . . . . . . . . . . 6.7 ptt180 -157.75 65.88 3.44 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 121.556 0.693 . . . . 75.200000000000003 110.875 179.946 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' M' M ' 23' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.77 -40.3 5.47 Favored 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.663 2.242 . . . . 72.310000000000002 112.351 -179.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' M' M ' 24' ' ' GLY . . . . . . . . . . . . . . . 84.47 50.08 4.39 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.76 -0.733 . . . . 42.219999999999999 112.517 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' M' M ' 25' ' ' GLY . . . . . . . . . . . . . . . -52.23 171.43 0.4 Allowed Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.733 -0.746 . . . . 41.310000000000002 112.539 -179.907 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' M' M ' 26' ' ' LYS . . . . . . . . . . . . . 8.5 pttm -172.61 35.14 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.889 0.376 . . . . 72.340000000000003 110.888 179.996 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' M' M ' 27' ' ' LYS . . . . . . . . . . . . . 30.7 tttm -175.02 112.82 0.14 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.233 -0.44 . . . . 74.420000000000002 110.924 179.869 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' M' M ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -108.13 -33.54 7.13 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.232 -0.44 . . . . 75.310000000000002 110.938 179.976 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' M' M ' 29' ' ' TYR . . . . . . . . . . . . . 9.3 m-85 -62.36 120.98 12.07 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.156 -0.475 . . . . 64.25 110.922 -179.865 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' M' M ' 30' ' ' LYS . . . . . . . . . . . . . 2.1 ptmt -95.87 27.24 3.63 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.13 -0.486 . . . . 54.420000000000002 110.864 179.921 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' M' M ' 31' ' ' LEU . . . . . 0.536 ' O ' HD12 ' M' ' 31' ' ' LEU . 10.0 tp -118.87 -31.38 4.8 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.233 -0.439 . . . . 63.310000000000002 110.945 179.937 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' M' M ' 32' ' ' LYS . . . . . 0.401 ' O ' HG23 ' M' ' 35' ' ' VAL . 5.4 mtpm? -49.89 -44.61 50.08 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.155 -0.475 . . . . 73.430000000000007 110.89 179.821 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' M' M ' 33' ' ' HIS . . . . . . . . . . . . . 3.6 t60 -50.71 -37.31 40.72 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.272 -0.422 . . . . 71.299999999999997 110.839 179.909 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' M' M ' 34' ' ' ILE . . . . . 0.569 HG13 ' HE3' ' A' ' 36' ' ' MET . 49.3 mm -50.27 -39.65 16.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.197 -0.456 . . . . 65.519999999999996 111.12 179.977 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' M' M ' 35' ' ' VAL . . . . . 0.401 HG23 ' O ' ' M' ' 32' ' ' LYS . 40.1 t -49.31 -39.95 13.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.159 -0.473 . . . . 73.409999999999997 111.123 179.876 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' M' M ' 36' ' ' TRP . . . . . . . . . . . . . 24.8 m0 -58.78 -39.45 81.07 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.173 -0.467 . . . . 75.230000000000004 110.96 179.964 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' M' M ' 37' ' ' ALA . . . . . 0.966 ' HB3' HD13 ' A' ' 39' ' ' LEU . . . -64.1 -18.62 64.57 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.257 -0.429 . . . . 74.299999999999997 111.084 179.851 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' M' M ' 38' ' ' SER . . . . . 0.42 ' CB ' HD23 ' A' ' 18' ' ' LEU . 0.7 OUTLIER -73.29 -17.92 61.26 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.227 -0.442 . . . . 74.150000000000006 110.877 -179.782 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' M' M ' 39' ' ' ARG . . . . . . . . . . . . . 22.5 mmm180 -62.76 -25.18 68.08 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.149 -0.478 . . . . 71.099999999999994 110.837 -179.94 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' M' M ' 40' ' ' GLU . . . . . . . . . . . . . 7.0 mp0 -77.21 -48.03 18.66 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.211 -0.45 . . . . 73.400000000000006 110.898 -179.917 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' M' M ' 41' ' ' LEU . . . . . 0.621 HD11 ' OG ' ' A' ' 38' ' ' SER . 18.0 mt -54.77 133.95 47.55 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.103 -0.499 . . . . 60.399999999999999 110.904 -179.932 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' M' M ' 42' ' ' GLU . . . . . . . . . . . . . 13.4 tp10 -105.28 138.57 41.28 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.166 -0.47 . . . . 64.450000000000003 110.868 179.989 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' M' M ' 43' ' ' ARG . . . . . . . . . . . . . 47.7 mtp180 . . . . . 0 C--N 1.329 -0.299 0 CA-C-N 116.164 -0.471 . . . . 71.540000000000006 110.855 -179.888 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 241' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 262' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 301' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 322' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.457 -0.086 0 CA-C-O 120.813 0.34 . . . . 71.329999999999998 111.142 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 21.9 t0 -84.96 142.56 29.56 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.202 -0.453 . . . . 73.430000000000007 110.876 179.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 64.1 mt-30 -154.66 154.26 32.65 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.24 -0.436 . . . . 74.150000000000006 110.872 -179.934 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.435 HD22 ' CD ' ' A' ' 8' ' ' GLN . 19.4 mt -105.15 151.57 23.87 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.166 -0.47 . . . . 64.329999999999998 110.944 179.97 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 57.8 p -119.12 173.12 7.1 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.172 -0.467 . . . . 74.430000000000007 111.164 179.993 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 11.1 tt0 -52.89 -29.29 27.49 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.263 -0.426 . . . . 62.409999999999997 110.853 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 33.1 tp10 -67.16 -41.6 85.71 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.174 -0.467 . . . . 71.319999999999993 110.895 -179.929 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . 0.435 ' CD ' HD22 ' A' ' 4' ' ' LEU . 19.3 tt0 -77.73 -39.25 45.07 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.129 -0.487 . . . . 74.209999999999994 110.864 -179.886 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 64.2 mt -69.84 -37.23 72.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.186 -0.461 . . . . 74.25 111.139 179.951 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -52.16 -50.81 61.06 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.203 -0.453 . . . . 43.520000000000003 111.097 179.831 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 17.5 mt-10 -57.02 -52.22 66.14 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.187 -0.46 . . . . 65.030000000000001 110.847 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.526 ' CB ' HD13 ' A' ' 69' ' ' LEU . 45.7 m-85 -58.02 -42.36 85.09 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.206 -0.452 . . . . 75.129999999999995 110.879 -179.907 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 21.7 ttpp -51.88 -41.26 61.77 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.114 -0.494 . . . . 74.140000000000001 110.932 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 56.5 tt0 -62.81 -32.87 74.15 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.261 -0.427 . . . . 74.510000000000005 110.829 180.0 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -68.91 -37.63 79.07 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.15 -0.477 . . . . 74.310000000000002 111.062 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 89.8 t80 -69.96 -53.22 18.77 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.257 -0.429 . . . . 75.310000000000002 110.912 -179.911 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 1.7 t -52.04 -35.79 48.3 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.153 -0.476 . . . . 71.230000000000004 110.855 -179.824 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 18.7 tp -59.81 -45.71 91.48 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.129 -0.487 . . . . 73.540000000000006 110.931 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.648 ' CD1' HG11 ' A' ' 35' ' ' VAL . 20.8 m-85 -73.07 -34.08 66.02 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.193 -0.458 . . . . 74.019999999999996 110.88 179.911 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 9.6 t0 -76.37 98.43 4.53 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.175 -0.466 . . . . 72.420000000000002 110.897 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 3.0 ttmp? -71.38 -55.73 7.39 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.188 -0.46 . . . . 72.230000000000004 110.903 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 22.3 p-10 -74.82 -10.04 59.12 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.227 -0.442 . . . . 74.409999999999997 110.863 179.867 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 52.25 44.26 57.67 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.732 -0.747 . . . . 72.040000000000006 112.486 -179.934 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 35.7 p-10 -89.58 -15.8 32.05 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.88 0.371 . . . . 70.409999999999997 110.893 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 103.92 -11.63 52.67 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.716 -0.754 . . . . 71.409999999999997 112.501 -179.906 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 19.8 p -128.01 133.26 49.13 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.736 0.303 . . . . 70.329999999999998 111.144 -179.866 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 24.5 mt -103.94 111.54 33.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.22 -0.445 . . . . 64.439999999999998 111.119 179.934 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.697 HG22 HG21 ' A' ' 62' ' ' THR . 20.3 p -94.81 -179.73 4.95 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.158 -0.474 . . . . 61.200000000000003 111.138 179.991 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 65.3 p -61.05 -32.04 71.67 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.185 -0.461 . . . . 75.349999999999994 111.164 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 24.1 tptm -68.31 -50.11 55.76 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.18 -0.463 . . . . 70.400000000000006 110.921 179.867 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.481 ' O ' HG23 ' A' ' 35' ' ' VAL . 35.9 mt-10 -70.33 -32.7 70.55 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.208 -0.451 . . . . 44.310000000000002 110.907 179.937 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.845 HD12 HD22 ' A' ' 48' ' ' LEU . 0.9 OUTLIER -74.14 -41.2 61.93 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.145 -0.48 . . . . 71.439999999999998 110.917 -179.963 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -71.72 -41.01 57.57 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.738 -0.744 . . . . 73.510000000000005 112.478 179.902 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 97.3 m -56.69 -56.43 21.47 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.82 0.343 . . . . 73.549999999999997 111.079 -179.839 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.648 HG11 ' CD1' ' A' ' 19' ' ' PHE . 91.9 t -52.01 -44.78 39.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.227 -0.442 . . . . 74.349999999999994 111.117 179.953 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 6.1 mmm -56.38 -34.46 66.7 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.173 -0.467 . . . . 54.020000000000003 110.913 179.874 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 35.9 ttp85 -57.53 -55.26 37.12 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.195 -0.457 . . . . 72.109999999999999 110.899 -179.912 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . 0.589 ' OG ' HD21 ' M' ' 41' ' ' LEU . 3.4 t -59.09 -27.0 65.15 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.205 -0.452 . . . . 71.030000000000001 110.842 -179.825 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.957 HD13 ' HB3' ' M' ' 37' ' ' ALA . 55.7 mt -78.98 -16.46 56.9 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.176 -0.466 . . . . 64.140000000000001 110.957 179.986 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 101.55 26.38 7.69 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.751 -0.738 . . . . 41.210000000000001 112.461 179.881 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 17.3 mt-30 -133.38 123.06 24.7 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.801 0.334 . . . . 70.230000000000004 110.92 -179.878 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 2.0 t30 -109.82 76.9 0.99 Allowed Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.6 0.714 . . . . 71.150000000000006 110.9 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.656 ' CG ' HD21 ' A' ' 48' ' ' LEU . 53.8 Cg_endo -69.79 161.81 44.51 Favored 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.651 2.234 . . . . 75.329999999999998 112.344 179.94 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 34.1 p -100.14 168.74 9.62 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.195 -0.457 . . . . 74.430000000000007 111.12 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 4.4 mp0 -54.43 -51.1 66.0 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.171 -0.468 . . . . 74.400000000000006 110.861 -179.972 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -67.28 -31.5 71.87 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.174 -0.467 . . . . 71.430000000000007 111.143 179.931 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -65.35 -46.77 78.87 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.199 -0.455 . . . . 73.129999999999995 110.866 -179.941 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.845 HD22 HD12 ' A' ' 32' ' ' LEU . 18.3 mt -67.78 -51.9 43.48 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.188 -0.46 . . . . 71.420000000000002 110.922 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 12.5 tp60 -52.91 -28.49 23.59 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.217 -0.447 . . . . 63.130000000000003 110.962 179.901 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -64.42 -49.83 70.0 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.159 -0.473 . . . . 63.299999999999997 110.888 179.973 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 6.1 ptp -76.35 -35.71 58.57 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.175 -0.466 . . . . 62.229999999999997 110.882 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 81.8 mt -66.09 -38.35 81.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.205 -0.452 . . . . 70.140000000000001 111.138 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 28.0 m-20 -63.59 -43.23 97.55 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.125 -0.489 . . . . 74.349999999999994 110.836 179.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -57.9 -43.54 86.23 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.204 -0.453 . . . . 73.140000000000001 110.856 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 36.0 m -81.56 -13.14 12.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.197 -0.456 . . . . 74.430000000000007 111.124 179.977 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 38.2 t0 -66.89 97.61 0.49 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.198 -0.456 . . . . 73.439999999999998 110.82 179.973 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.19 -44.31 10.98 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.156 -0.475 . . . . 65.329999999999998 111.132 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 9.3 p-10 -81.74 -0.17 41.76 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.207 -0.451 . . . . 74.219999999999999 110.837 179.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 54.51 57.37 17.7 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.716 -0.754 . . . . 70.400000000000006 112.507 -179.942 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 52.1 p-10 -114.53 -15.81 11.97 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.859 0.361 . . . . 63.43 110.852 -179.848 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 93.82 15.89 47.39 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.744 -0.741 . . . . 63.149999999999999 112.453 179.963 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . 0.697 HG21 HG22 ' A' ' 28' ' ' THR . 44.6 p -148.84 175.34 11.34 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.763 0.316 . . . . 73.120000000000005 111.13 -179.857 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 19.2 mt -107.84 109.78 29.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.197 -0.456 . . . . 74.010000000000005 111.161 179.897 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.4 t0 -75.28 -172.93 1.88 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.181 -0.463 . . . . 75.409999999999997 110.818 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.531 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 2.5 t80 -65.29 -58.28 12.68 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-O 121.635 0.731 . . . . 75.140000000000001 110.888 -179.933 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . 0.531 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 53.6 Cg_endo -69.76 -26.42 27.6 Favored 'Trans proline' 0 C--N 1.341 0.146 0 C-N-CA 122.649 2.233 . . . . 74.430000000000007 112.364 -179.994 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 20.3 mt-10 -62.07 -40.57 96.26 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.199 -0.455 . . . . 75.109999999999999 110.891 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 17.2 t80 -74.36 -35.86 63.57 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.158 -0.474 . . . . 75.099999999999994 110.903 -179.925 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.526 HD13 ' CB ' ' A' ' 12' ' ' PHE . 33.6 tp -69.92 -53.9 15.79 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.098 -0.501 . . . . 64.340000000000003 110.916 -179.958 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 14.0 t -53.29 -30.69 40.1 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.175 -0.466 . . . . 73.25 111.155 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 36.2 ttp -58.79 -50.62 73.27 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.222 -0.444 . . . . 71.099999999999994 110.856 179.956 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 1.4 mmt -66.08 -48.81 69.74 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.263 -0.426 . . . . 72.230000000000004 110.891 179.932 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -55.31 -28.65 55.06 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.262 -0.426 . . . . 72.409999999999997 111.055 179.904 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 23.3 ttm180 -64.71 -20.06 66.11 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.219 -0.446 . . . . 72.010000000000005 110.875 -179.866 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 8.5 ptmm? -51.66 -30.29 21.17 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.165 -0.471 . . . . 63.32 110.885 179.963 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 1.3 tpt -52.0 -35.67 47.37 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.27 -0.423 . . . . 72.299999999999997 110.872 179.9 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -175.92 139.42 0.39 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.183 -0.462 . . . . 75.209999999999994 110.898 179.959 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . 0.51 ' O ' HG23 ' A' ' 79' ' ' THR . 0.3 OUTLIER -168.26 -74.81 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.202 -0.454 . . . . 73.010000000000005 110.882 179.88 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . 0.51 HG23 ' O ' ' A' ' 78' ' ' ASP . 0.6 OUTLIER -164.21 176.69 8.98 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.188 -0.46 . . . . 62.020000000000003 111.149 -179.968 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -165.65 -74.41 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.192 -0.458 . . . . 64.420000000000002 110.859 179.936 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 89.0 p -77.26 -51.54 10.73 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.167 -0.469 . . . . 74.129999999999995 110.858 -179.724 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -55.04 -26.74 39.43 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.09 -0.505 . . . . 74.439999999999998 110.859 -179.932 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 12.9 tt0 -70.35 -52.8 19.99 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.188 -0.46 . . . . 62.140000000000001 110.869 -179.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 24.6 tp10 -69.39 -48.08 62.24 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.158 -0.473 . . . . 62.109999999999999 110.925 -179.964 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.834 HG21 HG22 ' A' ' 142' ' ' VAL . 56.3 mt -55.26 -46.83 78.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.127 -0.488 . . . . 75.420000000000002 111.08 -179.983 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 44.8 ttp180 -53.99 -33.49 57.2 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.188 -0.46 . . . . 72.25 110.843 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.716 ' O ' HG23 ' A' ' 91' ' ' VAL . 28.2 tt0 -76.63 -57.45 3.85 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.215 -0.448 . . . . 73.310000000000002 110.858 -179.879 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -53.53 -48.54 68.96 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.15 -0.477 . . . . 61.140000000000001 111.113 179.938 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 7.0 t80 -52.02 -51.26 58.57 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.21 -0.45 . . . . 71.120000000000005 110.855 -179.942 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 2.1 tmt_? -62.52 -46.95 86.05 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.166 -0.47 . . . . 72.299999999999997 110.891 -179.892 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . 0.716 HG23 ' O ' ' A' ' 87' ' ' GLU . 87.8 t -51.88 -47.91 40.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.189 -0.46 . . . . 71.450000000000003 111.143 179.941 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 18.6 m-85 -73.57 -26.48 60.85 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.148 -0.478 . . . . 64.409999999999997 110.889 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 31.6 t0 -69.77 95.2 0.87 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.118 -0.492 . . . . 73.5 110.854 179.985 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -78.65 -52.51 8.33 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.188 -0.46 . . . . 72.239999999999995 110.89 -179.998 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 53.6 p30 -72.66 -9.16 58.28 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.213 -0.448 . . . . 53.43 110.862 179.91 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 59.87 28.0 65.24 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.711 -0.757 . . . . 53.25 112.492 -179.955 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 46.0 p-10 -82.08 -16.14 51.06 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.871 0.367 . . . . 64.040000000000006 110.894 -179.859 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 88.1 18.66 55.39 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.743 -0.742 . . . . 25.539999999999999 112.507 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 12.9 m-85 -138.89 151.98 47.39 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.862 0.363 . . . . 74.409999999999997 110.911 -179.782 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 70.8 mt -115.73 122.34 69.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.154 -0.476 . . . . 65.439999999999998 111.167 179.907 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 53.4 p -114.81 -172.58 2.15 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.191 -0.459 . . . . 72.230000000000004 110.871 -179.877 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -74.75 -39.77 61.64 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.179 -0.464 . . . . 74.219999999999999 111.154 179.872 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -62.72 -39.98 95.77 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.188 -0.46 . . . . 55.200000000000003 111.09 179.906 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 21.6 mt-10 -76.95 -46.75 23.05 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.217 -0.447 . . . . 75.319999999999993 110.863 -179.89 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 29.7 tp -53.16 -43.97 67.46 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.136 -0.484 . . . . 74.400000000000006 110.926 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . 0.45 ' O ' HG23 ' A' ' 110' ' ' THR . 21.7 ttt-85 -51.99 -39.13 58.92 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.175 -0.466 . . . . 70.310000000000002 110.868 179.933 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 16.3 t60 -63.3 -35.53 80.67 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.192 -0.458 . . . . 70.120000000000005 110.847 -179.965 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 90.7 t -70.04 -52.29 32.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.218 -0.446 . . . . 50.329999999999998 111.143 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . 0.461 ' HB3' HD12 ' A' ' 116' ' ' LEU . 1.6 mmt -61.46 -44.68 96.67 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.172 -0.467 . . . . 74.109999999999999 110.849 179.906 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . 0.45 HG23 ' O ' ' A' ' 106' ' ' ARG . 12.9 p -53.01 -32.78 48.5 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.249 -0.432 . . . . 72.439999999999998 111.17 -179.871 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 8.9 t30 -74.62 -31.01 61.86 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.209 -0.451 . . . . 72.040000000000006 110.868 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.424 ' O ' HD23 ' A' ' 112' ' ' LEU . 1.1 tt -70.7 -26.07 63.25 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.193 -0.458 . . . . 72.5 110.925 179.966 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 100.12 23.28 10.69 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.758 -0.734 . . . . 61.210000000000001 112.468 179.928 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 54.7 tp10 -104.3 115.58 30.63 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.894 0.378 . . . . 75.329999999999998 110.88 -179.861 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . 0.464 ' O ' HD23 ' A' ' 116' ' ' LEU . 14.0 pttp -64.82 117.77 8.01 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.156 -0.475 . . . . 75.030000000000001 110.884 179.968 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.464 HD23 ' O ' ' A' ' 115' ' ' LYS . 17.2 mt -146.75 130.66 17.16 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.196 -0.456 . . . . 73.430000000000007 110.912 179.901 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . 0.475 ' O ' HG23 ' A' ' 121' ' ' VAL . 32.6 p -92.13 170.9 9.46 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.162 -0.472 . . . . 71.120000000000005 111.193 179.964 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 60.3 m-20 -53.24 -43.37 67.28 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.262 -0.426 . . . . 74.0 110.909 179.867 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 16.5 tp10 -65.55 -35.02 79.62 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.187 -0.461 . . . . 73.310000000000002 110.837 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . 0.422 ' HG2' HD22 ' A' ' 116' ' ' LEU . 2.2 tp10 -65.97 -40.72 91.5 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.178 -0.464 . . . . 71.439999999999998 110.859 -179.875 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.475 HG23 ' O ' ' A' ' 117' ' ' THR . 30.6 t -61.29 -38.94 80.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.147 -0.479 . . . . 74.019999999999996 111.164 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -52.02 -48.92 64.27 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.138 -0.483 . . . . 73.400000000000006 110.836 179.946 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -56.22 -29.3 60.78 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.203 -0.453 . . . . 74.140000000000001 110.859 -179.905 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . 0.542 ' HE1' HD11 ' M' ' 19' ' ' ILE . 0.1 OUTLIER -73.37 -59.62 2.62 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.191 -0.459 . . . . 64.439999999999998 110.831 179.997 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.44 HG23 HG23 ' A' ' 136' ' ' VAL . 33.0 mm -54.06 -35.81 29.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.238 -0.437 . . . . 55.240000000000002 111.134 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 69.2 ttt180 -63.44 -31.77 73.03 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.163 -0.471 . . . . 73.230000000000004 110.921 179.906 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 6.7 tp10 -71.43 -44.34 65.04 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.21 -0.45 . . . . 73.200000000000003 110.934 -179.959 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.714 ' HB3' HG22 ' A' ' 136' ' ' VAL . . . -76.06 -26.58 56.68 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.113 -0.494 . . . . 70.519999999999996 111.085 179.94 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 43.1 t0 -68.04 87.52 0.26 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.189 -0.46 . . . . 74.420000000000002 110.88 179.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . 0.42 HD12 ' HG2' ' A' ' 140' ' ' GLU . 60.8 mt -79.91 -49.33 19.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.175 -0.466 . . . . 70.510000000000005 111.126 -179.978 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 18.8 p30 -72.91 -8.7 56.82 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.167 -0.47 . . . . 72.200000000000003 110.841 179.842 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 63.9 44.67 95.73 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.751 -0.738 . . . . 71.120000000000005 112.521 -179.907 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 35.8 p-10 -91.18 -15.88 28.6 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.884 0.373 . . . . 65.120000000000005 110.862 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 104.19 2.33 44.86 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.758 -0.734 . . . . 72.120000000000005 112.457 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 7.2 tt0 -149.19 172.2 15.22 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.775 0.321 . . . . 60.409999999999997 110.935 -179.9 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 136' ' ' VAL . . . . . 0.714 HG22 ' HB3' ' A' ' 128' ' ' ALA . 61.6 t -105.63 109.74 28.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.176 -0.466 . . . . 41.420000000000002 111.142 179.938 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 23.1 p30 -89.09 165.46 14.49 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.167 -0.47 . . . . 71.329999999999998 110.934 179.948 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . 0.62 ' O ' HG23 ' A' ' 142' ' ' VAL . 87.1 t80 -52.05 -47.2 65.21 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.158 -0.474 . . . . 72.310000000000002 110.921 -179.898 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -52.01 -37.98 55.21 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.144 -0.48 . . . . 64.340000000000003 110.881 179.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . 0.42 ' HG2' HD12 ' A' ' 130' ' ' ILE . 19.4 mt-10 -78.39 -47.72 17.03 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.149 -0.478 . . . . 73.310000000000002 110.875 -179.906 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 65.2 t80 -54.33 -36.24 63.55 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.152 -0.476 . . . . 73.319999999999993 110.912 -179.936 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . 0.834 HG22 HG21 ' A' ' 85' ' ' ILE . 90.0 t -70.81 -43.04 77.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.147 -0.479 . . . . 42.130000000000003 111.16 179.93 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 20.5 tt0 -68.35 -29.98 68.83 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.162 -0.472 . . . . 73.439999999999998 110.872 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 7.9 tpt -72.03 -56.6 5.35 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.254 -0.43 . . . . 61.329999999999998 110.897 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 9.7 ttm -65.91 -26.06 67.44 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.256 -0.429 . . . . 65.239999999999995 110.891 179.927 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 2.1 m -108.29 21.28 17.55 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.238 -0.437 . . . . 73.329999999999998 111.135 -179.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -51.74 127.37 20.5 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.234 -0.439 . . . . 65.010000000000005 111.145 179.826 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 9.9 mmmt . . . . . 0 C--N 1.329 -0.301 0 CA-C-N 116.205 -0.452 . . . . 71.349999999999994 110.895 179.996 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' M' M ' 8' ' ' LEU . . . . . . . . . . . . . 17.4 mt . . . . . 0 C--O 1.232 0.142 0 CA-C-O 120.844 0.354 . . . . 74.129999999999995 110.868 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' M' M ' 9' ' ' SER . . . . . . . . . . . . . 74.0 m -137.16 168.37 19.74 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.167 -0.47 . . . . 75.329999999999998 110.866 -179.957 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' M' M ' 10' ' ' GLY . . . . . . . . . . . . . . . 148.84 54.04 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.805 -0.712 . . . . 52.140000000000001 112.509 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' M' M ' 11' ' ' GLY . . . . . . . . . . . . . . . 154.39 -126.75 1.96 Allowed Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.762 -0.732 . . . . 65.209999999999994 112.454 -179.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' M' M ' 12' ' ' GLU . . . . . . . . . . . . . 13.4 mm-40 57.19 94.06 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.886 0.374 . . . . 73.319999999999993 110.845 -179.85 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' M' M ' 13' ' ' LEU . . . . . 0.581 HD11 ' HG3' ' M' ' 15' ' ' LYS . 35.4 tp -52.66 125.41 16.52 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.198 -0.456 . . . . 75.319999999999993 110.909 -179.966 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' M' M ' 14' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -72.16 -30.46 65.01 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.16 -0.473 . . . . 71.010000000000005 110.879 179.858 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' M' M ' 15' ' ' LYS . . . . . 0.581 ' HG3' HD11 ' M' ' 13' ' ' LEU . 20.4 mtmm -54.6 -50.77 67.27 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.212 -0.449 . . . . 63.140000000000001 110.877 179.978 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' M' M ' 16' ' ' TRP . . . . . 0.547 ' CD1' HD23 ' M' ' 13' ' ' LEU . 26.4 m95 -52.28 -43.13 64.27 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.242 -0.435 . . . . 71.219999999999999 110.899 179.948 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' M' M ' 17' ' ' GLU . . . . . . . . . . . . . 24.5 tt0 -54.48 -27.52 38.39 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.223 -0.444 . . . . 72.129999999999995 110.903 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' M' M ' 18' ' ' LYS . . . . . . . . . . . . . 15.8 ttpt -69.7 -30.6 68.27 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.157 -0.474 . . . . 62.149999999999999 110.899 179.961 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' M' M ' 19' ' ' ILE . . . . . 0.542 HD11 ' HE1' ' A' ' 124' ' ' MET . 43.9 mt -80.91 -25.02 10.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.22 -0.445 . . . . 64.510000000000005 111.13 179.867 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' M' M ' 20' ' ' ARG . . . . . . . . . . . . . 31.9 ttm180 -53.28 -28.79 29.7 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.206 -0.452 . . . . 71.420000000000002 110.881 179.973 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' M' M ' 21' ' ' LEU . . . . . . . . . . . . . 9.5 mt 58.0 178.73 0.06 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.207 -0.451 . . . . 75.340000000000003 110.922 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' M' M ' 22' ' ' ARG . . . . . . . . . . . . . 13.0 ptm180 -179.29 57.15 0.09 OUTLIER Pre-proline 0 C--N 1.328 -0.358 0 CA-C-O 121.634 0.73 . . . . 73.209999999999994 110.902 179.951 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' M' M ' 23' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.73 -171.55 0.48 Allowed 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.702 2.268 . . . . 72.140000000000001 112.32 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' M' M ' 24' ' ' GLY . . . . . . . . . . . . . . . -146.03 19.57 1.76 Allowed Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.714 -0.755 . . . . 53.32 112.5 179.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' M' M ' 25' ' ' GLY . . . . . . . . . . . . . . . -169.95 28.08 0.12 Allowed Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.741 -0.742 . . . . 72.340000000000003 112.462 -179.938 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' M' M ' 26' ' ' LYS . . . . . . . . . . . . . 2.3 mmpt? -117.6 26.1 9.95 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.861 0.362 . . . . 74.219999999999999 110.874 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' M' M ' 27' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.05 172.05 19.14 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.228 -0.442 . . . . 53.109999999999999 110.908 179.818 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' M' M ' 28' ' ' GLN . . . . . . . . . . . . . 4.9 tt0 62.41 173.19 0.14 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.215 -0.448 . . . . 51.409999999999997 110.885 179.956 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' M' M ' 29' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -67.51 92.71 0.32 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.207 -0.451 . . . . 74.420000000000002 110.895 -179.821 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' M' M ' 30' ' ' LYS . . . . . . . . . . . . . 12.0 tttp -58.06 -22.84 52.13 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.123 -0.489 . . . . 74.5 110.867 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' M' M ' 31' ' ' LEU . . . . . 0.829 HD12 HD12 ' M' ' 34' ' ' ILE . 14.2 tp -70.62 -44.63 66.83 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.254 -0.43 . . . . 55.130000000000003 110.921 179.926 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' M' M ' 32' ' ' LYS . . . . . . . . . . . . . 5.7 mtmt -48.63 -44.87 37.73 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.182 -0.463 . . . . 75.450000000000003 110.894 179.851 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' M' M ' 33' ' ' HIS . . . . . . . . . . . . . 73.9 t60 -50.39 -39.33 46.65 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.227 -0.442 . . . . 74.099999999999994 110.843 179.898 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' M' M ' 34' ' ' ILE . . . . . 0.829 HD12 HD12 ' M' ' 31' ' ' LEU . 66.0 mt -50.6 -39.37 17.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.204 -0.453 . . . . 75.129999999999995 111.157 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' M' M ' 35' ' ' VAL . . . . . . . . . . . . . 39.8 t -49.36 -39.8 13.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.179 -0.464 . . . . 63.439999999999998 111.121 179.861 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' M' M ' 36' ' ' TRP . . . . . . . . . . . . . 24.2 m0 -58.71 -39.69 81.53 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.182 -0.463 . . . . 75.420000000000002 110.918 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' M' M ' 37' ' ' ALA . . . . . 0.957 ' HB3' HD13 ' A' ' 39' ' ' LEU . . . -63.87 -18.72 64.45 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.256 -0.429 . . . . 71.310000000000002 111.113 179.829 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' M' M ' 38' ' ' SER . . . . . . . . . . . . . 1.2 m -70.71 -17.91 62.81 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.266 -0.425 . . . . 73.530000000000001 110.873 -179.801 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' M' M ' 39' ' ' ARG . . . . . . . . . . . . . 37.2 mtp180 -53.29 -28.62 28.95 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.129 -0.487 . . . . 75.120000000000005 110.88 -179.916 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' M' M ' 40' ' ' GLU . . . . . . . . . . . . . 16.0 tp10 -85.98 -47.97 9.11 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.151 -0.477 . . . . 74.329999999999998 110.864 -179.912 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' M' M ' 41' ' ' LEU . . . . . 0.589 HD21 ' OG ' ' A' ' 38' ' ' SER . 10.5 mt -64.71 137.94 58.1 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.152 -0.476 . . . . 75.230000000000004 110.947 -179.969 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' M' M ' 42' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -143.81 104.74 4.21 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.233 -0.44 . . . . 72.120000000000005 110.901 179.977 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' M' M ' 43' ' ' ARG . . . . . . . . . . . . . 60.1 mtp180 . . . . . 0 C--N 1.328 -0.332 0 CA-C-N 116.169 -0.469 . . . . 74.129999999999995 110.875 -179.887 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 241' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 262' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 301' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 322' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.087 0 CA-C-O 120.836 0.351 . . . . 71.340000000000003 111.101 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 10.9 p-10 -138.33 39.72 2.27 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.195 -0.457 . . . . 62.030000000000001 110.871 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 11.8 pt20 -170.41 150.91 3.59 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.192 -0.458 . . . . 73.340000000000003 110.91 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.679 HD22 ' HG2' ' A' ' 8' ' ' GLN . 11.4 mt -80.15 140.17 36.49 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.169 -0.469 . . . . 72.540000000000006 110.96 179.999 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.697 ' O ' HD12 ' A' ' 9' ' ' ILE . 71.4 p -99.34 174.26 6.38 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.268 -0.424 . . . . 63.020000000000003 111.098 179.981 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 21.5 tt0 -55.29 -31.53 61.69 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.218 -0.447 . . . . 73.439999999999998 110.858 -179.974 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -67.65 -27.88 67.24 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.163 -0.472 . . . . 71.209999999999994 110.898 -179.911 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . 0.679 ' HG2' HD22 ' A' ' 4' ' ' LEU . 0.5 OUTLIER -78.0 -46.37 21.2 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.128 -0.487 . . . . 75.099999999999994 110.86 -179.916 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . 0.697 HD12 ' O ' ' A' ' 5' ' ' THR . 3.3 mp -72.19 -40.06 65.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.21 -0.45 . . . . 63.520000000000003 111.138 179.977 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -53.59 -32.09 49.6 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.215 -0.448 . . . . 55.009999999999998 111.057 179.831 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 27.3 mm-40 -74.79 -52.18 12.15 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.271 -0.422 . . . . 51.240000000000002 110.888 -179.894 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 38.1 m-85 -59.55 -45.97 90.24 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.134 -0.485 . . . . 74.420000000000002 110.889 -179.938 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 33.0 ttpt -53.87 -35.8 61.96 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.134 -0.485 . . . . 74.150000000000006 110.872 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -65.11 -30.85 71.82 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.269 -0.423 . . . . 73.420000000000002 110.913 179.978 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -70.68 -48.29 55.5 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.158 -0.474 . . . . 74.519999999999996 111.069 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 89.5 t80 -55.65 -54.24 46.59 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.221 -0.445 . . . . 73.030000000000001 110.887 -179.91 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 27.7 t -53.92 -29.56 42.67 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.109 -0.496 . . . . 74.219999999999999 110.874 -179.792 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 15.6 tp -65.72 -44.32 86.41 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.094 -0.503 . . . . 62.240000000000002 110.914 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.644 ' CD1' HG11 ' A' ' 35' ' ' VAL . 56.0 m-85 -75.71 -25.89 57.04 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.153 -0.476 . . . . 75.530000000000001 110.888 179.935 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 12.8 t0 -79.53 98.53 6.88 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.16 -0.473 . . . . 53.450000000000003 110.889 179.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 10.4 ttpp -67.11 -50.75 60.4 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.216 -0.447 . . . . 75.200000000000003 110.903 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 24.0 p-10 -81.0 -10.16 59.75 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.206 -0.452 . . . . 74.420000000000002 110.919 179.847 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 51.73 42.48 52.61 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.728 -0.749 . . . . 53.100000000000001 112.457 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 22.9 p-10 -88.51 -15.79 34.36 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.85 0.357 . . . . 55.520000000000003 110.854 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 102.18 17.64 19.65 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.715 -0.755 . . . . 41.020000000000003 112.477 -179.938 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -154.64 130.79 10.31 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.777 0.322 . . . . 73.430000000000007 111.127 -179.866 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 23.5 mt -97.73 122.38 49.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.167 -0.469 . . . . 72.219999999999999 111.12 179.915 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.583 HG22 HG21 ' A' ' 62' ' ' THR . 21.4 p -105.48 176.72 5.07 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.166 -0.47 . . . . 34.340000000000003 111.142 179.958 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 72.3 p -61.18 -29.34 69.74 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.239 -0.437 . . . . 71.140000000000001 111.129 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 28.4 mmtp -72.7 -49.97 27.9 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.202 -0.454 . . . . 73.040000000000006 110.883 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.42 ' O ' HG23 ' A' ' 35' ' ' VAL . 34.9 mt-10 -68.93 -32.68 72.48 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.21 -0.45 . . . . 75.030000000000001 110.896 179.988 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.546 ' O ' HD13 ' A' ' 32' ' ' LEU . 1.0 OUTLIER -71.52 -43.35 66.62 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.134 -0.484 . . . . 40.140000000000001 110.882 -179.978 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -70.26 -28.14 71.84 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.73 -0.747 . . . . 52.25 112.492 179.903 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 92.9 m -71.91 -58.21 3.65 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.826 0.346 . . . . 64.150000000000006 111.114 -179.851 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.644 HG11 ' CD1' ' A' ' 19' ' ' PHE . 96.0 t -51.62 -49.46 34.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.252 -0.431 . . . . 73.430000000000007 111.09 179.933 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 6.4 ttt -60.33 -39.31 86.6 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.199 -0.455 . . . . 72.030000000000001 110.868 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 51.4 ttp85 -52.74 -43.2 65.58 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.243 -0.435 . . . . 73.040000000000006 110.891 -179.944 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . 0.562 ' OG ' HD21 ' M' ' 41' ' ' LEU . 1.7 t -70.28 -25.23 63.24 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.222 -0.445 . . . . 73.329999999999998 110.861 -179.8 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 1.004 HD13 ' HB3' ' M' ' 37' ' ' ALA . 57.1 mt -76.15 -20.92 57.14 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.108 -0.496 . . . . 74.109999999999999 110.932 179.981 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 101.48 30.01 6.07 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.771 -0.728 . . . . 71.150000000000006 112.511 179.916 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 15.4 mm-40 -128.9 122.56 30.54 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.829 0.347 . . . . 73.409999999999997 110.882 -179.897 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 33.7 t-20 -109.93 80.68 1.82 Allowed Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.589 0.709 . . . . 51.439999999999998 110.89 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.74 168.03 22.71 Favored 'Trans proline' 0 C--O 1.231 0.158 0 C-N-CA 122.671 2.247 . . . . 65.530000000000001 112.346 179.937 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 18.0 p -93.05 158.74 15.63 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.187 -0.46 . . . . 73.430000000000007 111.105 -179.938 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.3 pt-20 -51.66 -45.0 63.23 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.197 -0.456 . . . . 74.099999999999994 110.893 179.993 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -72.29 -31.32 65.62 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.16 -0.473 . . . . 42.420000000000002 111.088 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -69.98 -42.23 73.38 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.208 -0.451 . . . . 74.209999999999994 110.838 -179.853 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.51 HD23 HD12 ' A' ' 32' ' ' LEU . 15.1 mt -59.57 -50.98 71.79 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.187 -0.46 . . . . 71.219999999999999 110.932 179.969 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -71.91 -28.36 63.43 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.186 -0.461 . . . . 61.420000000000002 110.94 179.923 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 7.8 t0 -56.49 -49.8 73.64 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.18 -0.464 . . . . 74.400000000000006 110.813 179.978 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . 0.461 ' HE1' HD11 ' M' ' 34' ' ' ILE . 6.7 ptp -69.49 -37.67 77.34 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.216 -0.447 . . . . 71.340000000000003 110.895 -179.957 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 96.5 mt -62.08 -52.48 59.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.191 -0.458 . . . . 73.409999999999997 111.126 179.928 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -55.06 -32.95 62.31 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.17 -0.468 . . . . 64.319999999999993 110.857 179.952 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -60.4 -55.29 35.36 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.185 -0.461 . . . . 74.129999999999995 110.852 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 17.2 m -77.12 -13.1 14.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.215 -0.448 . . . . 74.140000000000001 111.108 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 41.9 t0 -66.74 96.39 0.4 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.192 -0.458 . . . . 70.129999999999995 110.879 179.916 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.25 -36.81 16.52 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.217 -0.447 . . . . 71.319999999999993 111.08 179.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -86.45 -0.23 55.57 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.177 -0.465 . . . . 74.540000000000006 110.894 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 51.93 60.99 6.89 Favored Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.747 -0.739 . . . . 75.5 112.52 -179.946 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 51.5 p-10 -114.61 -15.89 11.92 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.814 0.34 . . . . 73.120000000000005 110.841 -179.822 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 93.82 17.93 39.48 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.709 -0.758 . . . . 74.120000000000005 112.446 179.941 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . 0.583 HG21 HG22 ' A' ' 28' ' ' THR . 70.0 p -151.07 174.29 13.35 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.758 0.313 . . . . 74.040000000000006 111.146 -179.819 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.488 HD13 HD21 ' M' ' 31' ' ' LEU . 22.6 mt -104.84 110.93 32.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.279 -0.419 . . . . 75.329999999999998 111.163 179.897 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -75.12 -172.98 1.84 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.219 -0.446 . . . . 70.319999999999993 110.873 179.874 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.536 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 2.5 t80 -65.52 -58.31 12.18 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-O 121.644 0.735 . . . . 74.409999999999997 110.947 -179.916 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . 0.536 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 53.7 Cg_endo -69.77 -26.98 27.0 Favored 'Trans proline' 0 C--N 1.341 0.16 0 C-N-CA 122.636 2.224 . . . . 74.329999999999998 112.38 179.962 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -60.91 -41.41 96.04 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.186 -0.461 . . . . 75.349999999999994 110.879 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 8.3 t80 -74.58 -35.72 63.03 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.154 -0.476 . . . . 73.439999999999998 110.909 -179.923 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 18.6 tp -68.76 -54.13 17.82 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.113 -0.494 . . . . 73.530000000000001 110.903 -179.976 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 14.6 t -52.97 -28.18 22.55 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.183 -0.462 . . . . 73.329999999999998 111.141 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . 0.44 ' SD ' HD23 ' M' ' 31' ' ' LEU . 43.2 ttp -64.92 -48.35 74.45 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.239 -0.437 . . . . 74.239999999999995 110.885 179.881 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . 0.614 ' HE3' HG21 ' M' ' 35' ' ' VAL . 0.1 OUTLIER -63.34 -38.21 90.26 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.248 -0.433 . . . . 72.319999999999993 110.876 179.944 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -74.8 -28.71 60.83 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.268 -0.424 . . . . 65.209999999999994 111.098 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 5.1 ttp180 -66.12 -18.98 65.69 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.249 -0.432 . . . . 54.409999999999997 110.862 -179.913 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 13.2 pttm -51.2 -30.76 18.15 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.195 -0.457 . . . . 55.32 110.886 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 25.0 tpp -53.82 -57.59 10.36 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.231 -0.441 . . . . 72.549999999999997 110.87 179.855 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 12.6 ttmt -172.58 176.25 3.28 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.257 -0.429 . . . . 71.030000000000001 110.9 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 12.8 m-20 63.4 80.91 0.22 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.196 -0.456 . . . . 71.239999999999995 110.848 179.868 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 14.6 t -163.8 26.75 0.08 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.209 -0.45 . . . . 73.120000000000005 111.139 -179.897 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -116.04 -25.08 7.79 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.211 -0.449 . . . . 64.510000000000005 110.84 179.911 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 83.7 p -62.87 -27.17 69.16 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.241 -0.436 . . . . 72.219999999999999 110.854 -179.778 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -98.13 -30.12 12.84 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.182 -0.463 . . . . 74.209999999999994 110.862 -179.926 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 13.1 tt0 -74.2 -45.47 48.09 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.16 -0.473 . . . . 72.150000000000006 110.871 -179.936 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -55.51 -35.38 65.55 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.179 -0.464 . . . . 54.039999999999999 110.877 -179.908 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.41 HG21 HG22 ' A' ' 142' ' ' VAL . 78.8 mt -63.35 -46.07 96.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.178 -0.464 . . . . 75.140000000000001 111.109 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.79 -53.34 13.68 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.182 -0.463 . . . . 75.510000000000005 110.889 179.97 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 11.6 tt0 -51.9 -46.37 64.54 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.205 -0.452 . . . . 71.019999999999996 110.874 -179.942 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -56.18 -41.44 75.52 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.182 -0.463 . . . . 74.219999999999999 111.08 179.936 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 9.4 t80 -54.74 -36.47 64.82 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.256 -0.429 . . . . 71.430000000000007 110.863 -179.899 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.76 -47.09 64.25 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.114 -0.494 . . . . 70.019999999999996 110.86 -179.888 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 84.5 t -53.22 -28.6 15.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.204 -0.453 . . . . 71.150000000000006 111.13 179.974 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.49 ' CE1' HG11 ' A' ' 108' ' ' VAL . 9.4 m-85 -94.9 -28.2 15.32 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.149 -0.478 . . . . 71.540000000000006 110.852 -179.959 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 37.9 t0 -81.48 81.72 7.51 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.169 -0.469 . . . . 45.200000000000003 110.848 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 4.5 mptp? -76.46 -43.78 38.43 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.228 -0.442 . . . . 75.409999999999997 110.87 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 10.0 p30 -72.87 -9.14 58.36 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.215 -0.448 . . . . 63.219999999999999 110.837 179.888 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 60.34 30.67 71.77 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.717 -0.754 . . . . 73.430000000000007 112.489 -179.925 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 33.8 p-10 -82.35 -16.15 50.23 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.927 0.394 . . . . 32.340000000000003 110.922 -179.879 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 80.37 18.73 70.67 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.7 -0.762 . . . . 44.039999999999999 112.53 179.969 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 22.8 m-85 -143.52 142.56 31.18 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.859 0.361 . . . . 73.420000000000002 110.934 -179.827 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 68.5 mt -103.92 119.46 52.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.173 -0.467 . . . . 74.530000000000001 111.106 179.907 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 8.5 p -105.05 -175.42 2.79 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.132 -0.485 . . . . 63.340000000000003 110.865 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . 0.544 ' O ' HG11 ' A' ' 121' ' ' VAL . . . -74.59 -28.09 60.76 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.104 -0.498 . . . . 43.310000000000002 111.083 179.938 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -71.89 -38.34 70.01 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.229 -0.441 . . . . 72.040000000000006 111.13 179.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -74.06 -44.59 53.69 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.196 -0.457 . . . . 74.129999999999995 110.903 -179.963 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 23.3 tp -52.88 -33.74 51.43 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.162 -0.472 . . . . 55.32 110.923 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . 0.691 ' O ' HG23 ' A' ' 110' ' ' THR . 53.3 ttp85 -70.57 -44.42 67.42 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.164 -0.471 . . . . 74.219999999999999 110.905 179.914 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 2.7 t60 -54.59 -37.24 65.3 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.172 -0.467 . . . . 63.109999999999999 110.891 179.986 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.49 HG11 ' CE1' ' A' ' 92' ' ' PHE . 38.4 t -73.47 -33.18 39.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.191 -0.459 . . . . 72.120000000000005 111.123 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . 0.542 ' HG3' HD12 ' A' ' 116' ' ' LEU . 15.4 mmt -70.38 -32.46 70.13 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.186 -0.461 . . . . 65.200000000000003 110.902 179.948 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . 0.691 HG23 ' O ' ' A' ' 106' ' ' ARG . 20.4 p -60.47 -43.02 97.35 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.226 -0.443 . . . . 74.109999999999999 111.161 -179.961 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 29.9 m-20 -74.66 -30.18 61.51 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.251 -0.431 . . . . 73.349999999999994 110.901 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 14.9 mt -70.69 -26.04 63.25 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.175 -0.466 . . . . 71.439999999999998 110.927 179.928 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 100.74 30.9 5.94 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.71 -0.757 . . . . 43.549999999999997 112.525 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -125.04 109.97 13.59 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.931 0.396 . . . . 64.530000000000001 110.888 -179.856 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . 0.509 ' O ' HD23 ' A' ' 116' ' ' LEU . 7.9 ptmm? -75.28 125.97 30.06 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.168 -0.469 . . . . 74.040000000000006 110.889 179.992 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.658 HD22 ' HG2' ' A' ' 120' ' ' GLU . 36.2 mt -145.12 163.35 34.58 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.201 -0.454 . . . . 72.209999999999994 110.94 179.903 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . 0.717 ' O ' HG23 ' A' ' 121' ' ' VAL . 23.7 p -118.73 173.7 6.71 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.219 -0.446 . . . . 72.129999999999995 111.101 179.971 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -58.01 -38.61 76.48 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.202 -0.454 . . . . 73.310000000000002 110.872 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 13.4 tt0 -71.96 -33.6 68.32 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.207 -0.451 . . . . 71.219999999999999 110.901 -179.92 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . 0.658 ' HG2' HD22 ' A' ' 116' ' ' LEU . 6.2 tp10 -71.1 -44.49 65.54 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.151 -0.477 . . . . 73.049999999999997 110.856 -179.951 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.717 HG23 ' O ' ' A' ' 117' ' ' THR . 39.6 t -58.93 -31.6 45.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.203 -0.453 . . . . 75.120000000000005 111.15 179.995 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -52.01 -42.3 62.92 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.172 -0.467 . . . . 64.120000000000005 110.863 179.906 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . 0.666 ' CD ' HD23 ' M' ' 13' ' ' LEU . 68.4 tt0 -57.81 -31.4 66.56 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.222 -0.445 . . . . 75.519999999999996 110.908 -179.921 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 30.7 mtp -76.07 -58.76 3.09 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.101 -0.499 . . . . 53.43 110.897 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.435 HG13 ' HB2' ' A' ' 102' ' ' ALA . 35.9 mm -53.9 -35.71 28.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.215 -0.448 . . . . 73.310000000000002 111.149 179.932 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 38.8 ttt180 -63.42 -31.85 73.13 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.175 -0.466 . . . . 73.150000000000006 110.91 179.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 -74.58 -52.38 11.95 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.198 -0.456 . . . . 72.030000000000001 110.88 -179.94 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.675 ' HB3' HG22 ' A' ' 136' ' ' VAL . . . -65.34 -34.43 78.3 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.137 -0.483 . . . . 54.299999999999997 111.078 179.999 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 49.3 t0 -68.43 86.72 0.3 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.184 -0.462 . . . . 72.239999999999995 110.859 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 59.0 mt -79.82 -46.22 22.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.181 -0.463 . . . . 70.420000000000002 111.135 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 21.2 p30 -72.78 -8.69 56.65 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.202 -0.454 . . . . 71.129999999999995 110.869 179.845 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 62.79 42.71 99.64 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.738 -0.744 . . . . 64.310000000000002 112.46 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 34.7 p-10 -87.75 -15.9 35.71 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.867 0.365 . . . . 74.010000000000005 110.914 179.99 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 104.1 2.34 45.15 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.719 -0.753 . . . . 72.430000000000007 112.473 -179.941 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 4.2 tt0 -149.21 172.23 15.18 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.808 0.337 . . . . 64.400000000000006 110.921 -179.858 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 136' ' ' VAL . . . . . 0.675 HG22 ' HB3' ' A' ' 128' ' ' ALA . 98.7 t -106.91 109.98 30.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.185 -0.461 . . . . 61.420000000000002 111.132 179.913 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 20.2 p30 -90.99 165.12 13.71 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.159 -0.473 . . . . 55.109999999999999 110.885 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 34.2 t80 -52.16 -46.76 65.6 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.155 -0.475 . . . . 63.0 110.919 -179.912 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 19.0 tp10 -52.0 -40.15 60.54 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.15 -0.477 . . . . 74.209999999999994 110.835 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 22.9 mt-10 -78.4 -32.68 48.91 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.206 -0.452 . . . . 74.209999999999994 110.916 -179.935 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 65.5 t80 -67.8 -39.01 84.03 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.152 -0.476 . . . . 73.010000000000005 110.89 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . 0.41 HG22 HG21 ' A' ' 85' ' ' ILE . 95.7 t -71.25 -50.85 38.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.148 -0.478 . . . . 72.239999999999995 111.142 179.96 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 14.9 tt0 -61.32 -38.68 87.77 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.221 -0.445 . . . . 74.109999999999999 110.898 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 15.4 tpt -68.9 -55.58 10.6 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.218 -0.446 . . . . 72.319999999999993 110.862 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 12.5 ttm -60.54 -29.54 69.2 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.234 -0.439 . . . . 73.420000000000002 110.921 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 1.8 m -105.74 21.31 17.47 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.192 -0.458 . . . . 64.450000000000003 111.143 -179.927 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -51.83 131.16 30.5 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.207 -0.451 . . . . 72.430000000000007 111.1 179.839 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 22.9 pttm . . . . . 0 C--N 1.329 -0.32 0 CA-C-N 116.212 -0.449 . . . . 74.310000000000002 110.842 179.988 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' M' M ' 8' ' ' LEU . . . . . . . . . . . . . 3.1 pp . . . . . 0 C--O 1.231 0.12 0 CA-C-O 120.813 0.34 . . . . 75.120000000000005 110.908 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' M' M ' 9' ' ' SER . . . . . . . . . . . . . 79.6 p -143.59 160.28 40.92 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.205 -0.452 . . . . 45.32 110.908 -179.906 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' M' M ' 10' ' ' GLY . . . . . . . . . . . . . . . -112.28 -171.64 18.65 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.741 -0.743 . . . . 73.439999999999998 112.474 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' M' M ' 11' ' ' GLY . . . . . . . . . . . . . . . 73.29 29.15 64.7 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.729 -0.748 . . . . 52.119999999999997 112.486 -179.87 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' M' M ' 12' ' ' GLU . . . . . . . . . . . . . 20.0 mt-10 -143.65 -170.81 3.39 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.908 0.385 . . . . 64.319999999999993 110.892 -179.917 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' M' M ' 13' ' ' LEU . . . . . 0.666 HD23 ' CD ' ' A' ' 123' ' ' GLU . 1.0 OUTLIER -87.44 76.65 9.0 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.169 -0.469 . . . . 60.130000000000003 110.91 -179.994 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' M' M ' 14' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -102.43 23.7 11.44 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.21 -0.45 . . . . 72.329999999999998 110.894 179.819 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' M' M ' 15' ' ' LYS . . . . . 0.433 ' HB3' ' HE3' ' A' ' 109' ' ' MET . 41.1 mttp -77.0 -49.95 14.26 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.14 -0.482 . . . . 71.099999999999994 110.885 179.988 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' M' M ' 16' ' ' TRP . . . . . 0.62 ' CE3' HD12 ' M' ' 19' ' ' ILE . 12.0 m95 -53.01 -40.56 63.93 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.233 -0.439 . . . . 72.450000000000003 110.912 179.96 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' M' M ' 17' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -56.35 -26.05 51.32 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.267 -0.424 . . . . 62.039999999999999 110.923 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' M' M ' 18' ' ' LYS . . . . . . . . . . . . . 29.1 tttp -78.69 -26.58 44.95 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.146 -0.479 . . . . 63.039999999999999 110.908 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' M' M ' 19' ' ' ILE . . . . . 0.62 HD12 ' CE3' ' M' ' 16' ' ' TRP . 39.3 mt -87.79 -25.18 6.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.226 -0.443 . . . . 74.549999999999997 111.1 179.88 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' M' M ' 20' ' ' ARG . . . . . . . . . . . . . 25.5 ttp180 -52.11 -37.55 54.49 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.228 -0.442 . . . . 73.439999999999998 110.864 179.962 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' M' M ' 21' ' ' LEU . . . . . . . . . . . . . 7.8 mt 55.31 -175.36 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.19 -0.459 . . . . 73.329999999999998 110.929 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' M' M ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -139.14 149.16 60.12 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.619 0.723 . . . . 74.430000000000007 110.895 179.971 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' M' M ' 23' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.73 101.42 0.9 Allowed 'Trans proline' 0 C--N 1.342 0.201 0 C-N-CA 122.651 2.234 . . . . 71.219999999999999 112.343 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' M' M ' 24' ' ' GLY . . . . . . . . . . . . . . . -145.89 39.56 1.13 Allowed Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.69 -0.766 . . . . 54.32 112.437 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' M' M ' 25' ' ' GLY . . . . . . . . . . . . . . . -130.78 171.94 20.69 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.746 -0.74 . . . . 44.530000000000001 112.501 -179.924 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' M' M ' 26' ' ' LYS . . . . . . . . . . . . . 4.2 ttpm? -78.04 -73.05 0.33 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.834 0.349 . . . . 62.350000000000001 110.884 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' M' M ' 27' ' ' LYS . . . . . . . . . . . . . 5.4 mptp? 58.84 176.9 0.07 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.206 -0.452 . . . . 65.430000000000007 110.87 179.864 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' M' M ' 28' ' ' GLN . . . . . . . . . . . . . 2.4 pp0? -179.14 173.91 1.1 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.212 -0.449 . . . . 52.32 110.916 179.978 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' M' M ' 29' ' ' TYR . . . . . . . . . . . . . 11.7 m-85 -90.69 126.96 36.14 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.218 -0.446 . . . . 74.129999999999995 110.925 -179.897 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' M' M ' 30' ' ' LYS . . . . . . . . . . . . . 15.8 tttp -88.47 8.18 29.23 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.108 -0.496 . . . . 70.209999999999994 110.859 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' M' M ' 31' ' ' LEU . . . . . 0.643 HD12 HD12 ' M' ' 34' ' ' ILE . 15.5 tp -106.77 -49.77 3.24 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.233 -0.44 . . . . 63.420000000000002 110.955 179.918 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' M' M ' 32' ' ' LYS . . . . . . . . . . . . . 39.7 tttm -48.23 -45.78 34.59 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.158 -0.473 . . . . 73.519999999999996 110.912 179.789 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' M' M ' 33' ' ' HIS . . . . . . . . . . . . . 19.8 t-160 -51.21 -39.3 56.21 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.257 -0.429 . . . . 64.109999999999999 110.88 179.881 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' M' M ' 34' ' ' ILE . . . . . 0.643 HD12 HD12 ' M' ' 31' ' ' LEU . 72.5 mt -51.18 -37.78 18.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.196 -0.456 . . . . 64.450000000000003 111.186 179.982 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' M' M ' 35' ' ' VAL . . . . . 0.614 HG21 ' HE3' ' A' ' 72' ' ' MET . 46.3 t -49.11 -39.11 12.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.157 -0.474 . . . . 64.450000000000003 111.133 179.86 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' M' M ' 36' ' ' TRP . . . . . . . . . . . . . 19.5 m0 -58.44 -40.03 81.47 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.154 -0.475 . . . . 74.25 110.892 179.967 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' M' M ' 37' ' ' ALA . . . . . 1.004 ' HB3' HD13 ' A' ' 39' ' ' LEU . . . -63.2 -18.7 63.78 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.191 -0.459 . . . . 75.310000000000002 111.097 179.931 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' M' M ' 38' ' ' SER . . . . . . . . . . . . . 1.5 m -68.24 -18.07 64.46 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.185 -0.462 . . . . 70.450000000000003 110.853 -179.727 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' M' M ' 39' ' ' ARG . . . . . . . . . . . . . 41.2 mtp180 -52.49 -29.56 25.54 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.087 -0.506 . . . . 43.229999999999997 110.862 -179.946 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' M' M ' 40' ' ' GLU . . . . . . . . . . . . . 21.7 mt-10 -82.06 -48.05 11.87 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.178 -0.465 . . . . 64.349999999999994 110.892 -179.915 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' M' M ' 41' ' ' LEU . . . . . 0.562 HD21 ' OG ' ' A' ' 38' ' ' SER . 9.8 mt -62.36 175.63 0.73 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.184 -0.462 . . . . 72.340000000000003 110.929 179.998 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' M' M ' 42' ' ' GLU . . . . . . . . . . . . . 56.5 mt-10 -150.01 -178.76 6.67 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.214 -0.448 . . . . 51.210000000000001 110.93 179.905 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' M' M ' 43' ' ' ARG . . . . . . . . . . . . . 2.6 tmm_? . . . . . 0 C--N 1.329 -0.285 0 CA-C-N 116.155 -0.475 . . . . 73.329999999999998 110.863 -179.92 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 241' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 262' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 301' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 322' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.103 0 CA-C-O 120.858 0.361 . . . . 64.120000000000005 111.089 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 46.7 m-20 -69.39 143.71 53.6 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.172 -0.467 . . . . 74.349999999999994 110.855 -179.982 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 12.1 mm100 -95.83 -34.85 11.71 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.211 -0.45 . . . . 73.340000000000003 110.868 -179.867 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 10.6 mt -105.9 146.84 29.45 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.204 -0.453 . . . . 72.439999999999998 110.904 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 4.2 p -120.45 177.08 5.18 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.218 -0.446 . . . . 71.219999999999999 111.146 179.938 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 66.6 tt0 -57.48 -29.87 64.63 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.208 -0.451 . . . . 55.039999999999999 110.852 -179.923 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -68.0 -40.69 82.96 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.181 -0.463 . . . . 63.140000000000001 110.863 -179.931 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 35.0 tt0 -78.02 -36.75 48.31 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.182 -0.463 . . . . 63.219999999999999 110.878 -179.901 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 62.1 mt -72.53 -37.68 57.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.246 -0.434 . . . . 73.239999999999995 111.143 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -56.03 -45.23 79.23 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.115 -0.493 . . . . 62.149999999999999 111.082 179.872 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -66.44 -32.2 73.42 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.2 -0.455 . . . . 64.239999999999995 110.921 -179.958 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.413 ' HB3' HD13 ' A' ' 69' ' ' LEU . 9.4 m-85 -73.44 -45.93 51.44 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.119 -0.491 . . . . 63.43 110.888 -179.95 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 34.9 ttmt -56.76 -37.61 71.29 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.172 -0.467 . . . . 63.420000000000002 110.907 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -59.92 -30.69 69.22 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.272 -0.422 . . . . 75.540000000000006 110.891 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -67.26 -42.39 83.97 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.174 -0.466 . . . . 63.219999999999999 111.119 179.933 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 40.8 t80 -58.16 -54.13 50.39 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.238 -0.437 . . . . 65.329999999999998 110.891 -179.928 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 6.8 t -52.26 -31.09 30.84 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.146 -0.479 . . . . 75.239999999999995 110.833 -179.814 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 16.2 tp -65.74 -49.34 68.78 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.187 -0.461 . . . . 71.239999999999995 110.919 179.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.826 ' HA ' HG21 ' A' ' 35' ' ' VAL . 33.1 m-85 -72.28 -25.97 61.8 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.178 -0.464 . . . . 75.519999999999996 110.853 179.96 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 13.5 t0 -86.05 98.53 10.9 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.163 -0.472 . . . . 64.439999999999998 110.901 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 6.7 tppt? -68.96 -52.78 25.42 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.23 -0.441 . . . . 71.340000000000003 110.869 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 24.1 p-10 -77.08 -10.08 59.15 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.241 -0.436 . . . . 75.310000000000002 110.913 179.861 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 52.11 48.4 52.77 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.773 -0.727 . . . . 64.099999999999994 112.433 -179.978 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 31.8 p-10 -88.53 -15.71 34.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.818 0.342 . . . . 74.340000000000003 110.889 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 105.41 -11.64 47.25 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.718 -0.753 . . . . 72.299999999999997 112.5 -179.925 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 4.2 p -132.13 130.7 41.5 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.712 0.292 . . . . 72.310000000000002 111.151 -179.873 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.487 HG22 ' HB2' ' A' ' 32' ' ' LEU . 23.2 mt -89.7 114.01 26.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.239 -0.437 . . . . 64.25 111.117 179.906 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.583 HG22 HG21 ' A' ' 62' ' ' THR . 44.8 p -93.38 170.67 9.44 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.216 -0.447 . . . . 74.530000000000001 111.113 179.957 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.584 HG22 HD12 ' A' ' 52' ' ' ILE . 82.4 p -58.17 -34.47 70.35 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.213 -0.449 . . . . 72.25 111.119 -179.955 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 30.8 tptt -79.84 -50.13 10.96 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.213 -0.448 . . . . 74.340000000000003 110.922 179.882 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.53 ' OE1' HG23 ' A' ' 28' ' ' THR . 60.1 mt-10 -59.03 -34.69 72.2 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.189 -0.46 . . . . 72.409999999999997 110.928 179.931 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.487 ' HB2' HG22 ' A' ' 27' ' ' ILE . 4.1 tt -74.22 -55.68 5.78 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.138 -0.483 . . . . 73.5 110.894 -179.986 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -52.3 -27.87 25.64 Favored Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.752 -0.737 . . . . 73.340000000000003 112.485 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 96.3 m -58.5 -58.06 10.2 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.838 0.352 . . . . 61.229999999999997 111.131 -179.821 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.826 HG21 ' HA ' ' A' ' 19' ' ' PHE . 98.7 t -56.21 -47.55 80.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.225 -0.443 . . . . 72.230000000000004 111.084 179.933 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 7.0 mtp -51.86 -41.36 61.8 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.201 -0.454 . . . . 72.030000000000001 110.879 179.897 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 27.9 ttt180 -53.09 -45.44 68.2 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.244 -0.435 . . . . 65.430000000000007 110.829 -179.896 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . 0.655 ' OG ' HD11 ' M' ' 41' ' ' LEU . 1.8 p -61.25 -26.14 67.55 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.247 -0.433 . . . . 64.340000000000003 110.843 -179.739 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.996 HD13 ' HB3' ' M' ' 37' ' ' ALA . 18.0 mt -89.86 -16.35 30.27 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.163 -0.472 . . . . 72.450000000000003 110.889 -180.0 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 101.44 27.34 7.26 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.725 -0.75 . . . . 64.420000000000002 112.467 179.853 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 22.0 mm100 -116.88 106.5 13.52 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.78 0.324 . . . . 61.25 110.901 -179.916 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 14.6 t-20 -109.99 76.56 1.0 Allowed Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 121.637 0.732 . . . . 74.209999999999994 110.865 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.75 168.09 22.55 Favored 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.656 2.237 . . . . 72.310000000000002 112.334 179.925 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 19.0 p -87.6 156.67 19.39 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.195 -0.457 . . . . 63.130000000000003 111.162 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -51.8 -41.77 61.96 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.205 -0.452 . . . . 61.32 110.893 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.23 -32.16 64.58 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.187 -0.46 . . . . 71.439999999999998 111.098 179.901 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 68.3 tt0 -68.86 -50.08 52.83 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.222 -0.445 . . . . 64.230000000000004 110.915 -179.887 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 16.0 mt -55.12 -45.24 75.54 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.087 -0.506 . . . . 64.239999999999995 110.922 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 3.8 tm0? -71.77 -28.68 63.8 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.166 -0.47 . . . . 73.109999999999999 110.895 179.917 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -63.71 -49.76 71.82 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.231 -0.44 . . . . 74.450000000000003 110.901 179.946 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 5.5 ptp -66.2 -37.47 85.68 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.19 -0.459 . . . . 62.329999999999998 110.872 179.988 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.584 HD12 HG22 ' A' ' 29' ' ' THR . 66.0 mt -67.07 -38.1 80.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.203 -0.453 . . . . 72.409999999999997 111.059 -179.958 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 14.3 m-20 -59.58 -37.63 79.05 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.231 -0.44 . . . . 75.299999999999997 110.881 179.935 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 70.0 mm-40 -61.98 -47.95 82.52 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.196 -0.456 . . . . 61.409999999999997 110.897 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 16.9 m -77.81 -15.24 14.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.141 -0.482 . . . . 62.130000000000003 111.099 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 37.3 t0 -66.8 94.26 0.3 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.223 -0.444 . . . . 72.450000000000003 110.861 179.929 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.27 -35.92 16.99 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.182 -0.463 . . . . 53.219999999999999 111.11 179.945 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 1.9 p-10 -88.67 -0.17 57.02 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.235 -0.439 . . . . 70.140000000000001 110.867 179.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 54.5 60.09 9.12 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.746 -0.74 . . . . 61.109999999999999 112.5 -179.913 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 50.9 p-10 -114.6 -15.79 11.94 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.912 0.386 . . . . 72.439999999999998 110.91 -179.921 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 93.4 13.26 56.06 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.771 -0.728 . . . . 53.130000000000003 112.504 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . 0.583 HG21 HG22 ' A' ' 28' ' ' THR . 70.3 p -150.65 171.93 16.36 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.732 0.301 . . . . 75.5 111.157 -179.88 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 16.1 mt -96.1 115.17 34.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.223 -0.444 . . . . 73.430000000000007 111.1 179.947 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.7 t0 -78.78 -175.26 4.35 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.18 -0.464 . . . . 61.350000000000001 110.884 179.866 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.531 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 2.5 t80 -63.5 -58.37 15.75 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.634 0.73 . . . . 72.129999999999995 110.898 -179.888 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . 0.531 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 53.6 Cg_endo -69.79 -30.64 21.82 Favored 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.624 2.216 . . . . 74.239999999999995 112.343 -179.994 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 55.8 mt-10 -59.0 -40.77 85.91 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.268 -0.424 . . . . 71.329999999999998 110.909 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 12.7 t80 -74.17 -35.68 64.02 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.171 -0.468 . . . . 73.409999999999997 110.911 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.413 HD13 ' HB3' ' A' ' 12' ' ' PHE . 27.6 tp -68.4 -53.88 20.86 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.141 -0.482 . . . . 43.210000000000001 110.937 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 15.3 t -53.63 -29.17 36.88 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.184 -0.462 . . . . 61.119999999999997 111.133 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . 0.495 ' HE3' HD11 ' M' ' 31' ' ' LEU . 35.4 ttp -62.78 -43.49 98.66 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.237 -0.438 . . . . 70.400000000000006 110.856 179.964 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . 0.585 ' HE3' HG11 ' M' ' 35' ' ' VAL . 3.3 mmt -71.4 -29.72 65.25 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.236 -0.438 . . . . 71.310000000000002 110.9 179.927 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -60.2 -28.73 68.22 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.226 -0.443 . . . . 62.509999999999998 111.136 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -63.01 -24.5 67.95 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.162 -0.472 . . . . 62.25 110.898 -179.91 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 12.7 ttpt -51.83 -30.18 22.42 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.165 -0.471 . . . . 71.430000000000007 110.93 179.918 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 3.2 tmm? -52.14 -32.93 37.82 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.208 -0.451 . . . . 72.030000000000001 110.855 179.902 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 21.7 ttmm -73.24 -68.58 0.48 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.274 -0.421 . . . . 65.120000000000005 110.912 179.935 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 52.0 t0 52.13 79.19 0.11 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.248 -0.433 . . . . 75.129999999999995 110.868 179.844 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 4.0 m -78.99 69.27 5.12 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.164 -0.471 . . . . 54.420000000000002 111.145 -179.902 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -166.41 -39.52 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.249 -0.432 . . . . 65.329999999999998 110.839 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 3.3 m -61.49 -46.07 91.57 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.222 -0.444 . . . . 44.140000000000001 110.808 -179.678 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -52.34 -29.87 25.83 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.19 -0.459 . . . . 72.030000000000001 110.881 -179.958 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 28.7 tt0 -72.36 -37.42 68.8 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.136 -0.484 . . . . 73.420000000000002 110.903 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -77.76 -43.97 29.1 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.166 -0.47 . . . . 74.219999999999999 110.861 -179.915 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.458 HG21 ' HA ' ' A' ' 142' ' ' VAL . 70.6 mt -56.91 -50.96 73.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.146 -0.479 . . . . 75.439999999999998 111.181 179.958 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 45.7 ttp180 -62.5 -28.32 69.75 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.176 -0.465 . . . . 64.120000000000005 110.924 179.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.73 ' O ' HG23 ' A' ' 91' ' ' VAL . 10.0 mm-40 -76.13 -46.87 26.63 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.207 -0.451 . . . . 73.510000000000005 110.922 179.983 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . 0.628 ' HB1' ' CE2' ' A' ' 92' ' ' PHE . . . -63.75 -42.68 97.8 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.171 -0.468 . . . . 74.25 111.1 179.924 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 9.9 t80 -52.02 -50.69 60.9 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.211 -0.45 . . . . 74.319999999999993 110.88 -179.905 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 32.1 ttm180 -62.75 -35.98 81.56 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.141 -0.481 . . . . 73.230000000000004 110.858 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . 0.73 HG23 ' O ' ' A' ' 87' ' ' GLU . 85.3 t -63.91 -42.67 96.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.186 -0.461 . . . . 73.109999999999999 111.134 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.628 ' CE2' ' HB1' ' A' ' 88' ' ' ALA . 9.2 m-85 -78.2 -31.18 49.31 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.157 -0.474 . . . . 75.439999999999998 110.899 -179.983 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 22.7 t0 -61.25 96.91 0.06 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.168 -0.469 . . . . 75.450000000000003 110.894 179.98 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 13.4 mmmt -77.35 -53.34 7.8 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.23 -0.441 . . . . 61.140000000000001 110.872 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 16.5 p30 -74.25 -9.19 58.36 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.226 -0.443 . . . . 64.549999999999997 110.838 179.902 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 59.69 25.86 61.78 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.75 -0.738 . . . . 54.100000000000001 112.465 -179.917 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 40.5 p-10 -82.11 -16.16 50.91 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.824 0.345 . . . . 73.450000000000003 110.901 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 86.7 18.7 57.93 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.735 -0.745 . . . . 73.219999999999999 112.485 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 13.0 m-85 -137.85 134.27 34.9 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.888 0.375 . . . . 73.109999999999999 110.933 -179.816 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 71.4 mt -100.04 125.6 53.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.098 -0.501 . . . . 51.520000000000003 111.102 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 86.0 p -109.17 -172.81 2.12 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.198 -0.455 . . . . 63.140000000000001 110.885 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . 0.517 ' HB1' ' CG1' ' A' ' 121' ' ' VAL . . . -72.74 -37.11 67.81 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.114 -0.494 . . . . 52.439999999999998 111.074 179.883 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -70.24 -49.92 45.1 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.238 -0.437 . . . . 51.200000000000003 111.101 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -62.56 -48.5 79.19 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.227 -0.442 . . . . 75.430000000000007 110.867 -179.911 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.44 HD11 ' CD1' ' M' ' 19' ' ' ILE . 30.4 tp -56.35 -26.85 54.06 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.169 -0.468 . . . . 74.400000000000006 110.904 -179.933 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . 0.451 ' O ' HG23 ' A' ' 110' ' ' THR . 17.9 ttm180 -73.35 -29.04 62.39 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.175 -0.466 . . . . 63.219999999999999 110.875 179.938 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 19.8 t60 -66.95 -34.69 78.32 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.191 -0.459 . . . . 73.099999999999994 110.871 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 40.9 t -74.49 -39.58 47.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.17 -0.468 . . . . 72.319999999999993 111.168 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 2.3 mmt -73.87 -38.69 64.34 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.164 -0.471 . . . . 61.549999999999997 110.913 179.857 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . 0.451 HG23 ' O ' ' A' ' 106' ' ' ARG . 3.0 p -54.12 -32.75 56.0 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.209 -0.45 . . . . 74.430000000000007 111.165 -179.935 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -74.68 -28.35 60.79 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.218 -0.446 . . . . 74.019999999999996 110.887 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -70.68 -25.95 63.21 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.19 -0.459 . . . . 74.129999999999995 110.933 179.947 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 100.84 19.4 17.51 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.73 -0.748 . . . . 52.43 112.518 179.93 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -102.81 127.9 49.79 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.873 0.368 . . . . 73.400000000000006 110.896 -179.874 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 34.0 mttp -80.83 117.51 21.55 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.186 -0.461 . . . . 73.319999999999993 110.929 179.945 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 15.3 mt -130.02 113.34 14.44 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.253 -0.43 . . . . 75.030000000000001 110.909 179.933 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . 0.588 ' O ' HG23 ' A' ' 121' ' ' VAL . 75.1 p -81.91 171.22 14.71 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.17 -0.468 . . . . 71.120000000000005 111.156 179.932 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 46.7 m-20 -52.01 -36.68 50.78 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.238 -0.437 . . . . 74.040000000000006 110.826 179.9 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -75.23 -33.4 61.35 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.163 -0.471 . . . . 73.109999999999999 110.928 -179.91 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -69.63 -42.19 74.62 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.111 -0.495 . . . . 64.140000000000001 110.906 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.588 HG23 ' O ' ' A' ' 117' ' ' THR . 21.8 t -61.03 -38.62 79.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.163 -0.471 . . . . 72.120000000000005 111.119 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 50.0 t0 -56.88 -45.48 82.49 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.212 -0.449 . . . . 65.510000000000005 110.9 179.901 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 15.5 tm-20 -57.51 -34.26 68.91 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.193 -0.458 . . . . 73.319999999999993 110.839 -179.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . 0.406 ' HE2' ' HG3' ' M' ' 15' ' ' LYS . 27.1 mtp -70.69 -59.56 2.75 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.2 -0.454 . . . . 62.329999999999998 110.862 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.45 HG13 ' HB2' ' A' ' 102' ' ' ALA . 36.3 mm -53.97 -35.5 28.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.211 -0.449 . . . . 74.310000000000002 111.134 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 56.5 ttt85 -63.07 -31.84 73.08 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.171 -0.468 . . . . 75.549999999999997 110.863 179.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -75.11 -52.38 11.14 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.148 -0.478 . . . . 64.019999999999996 110.9 -179.959 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.659 ' HB3' HG22 ' A' ' 136' ' ' VAL . . . -64.88 -34.41 78.32 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.168 -0.469 . . . . 73.25 111.126 179.909 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 49.0 t0 -68.37 86.9 0.29 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.197 -0.456 . . . . 74.099999999999994 110.853 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 64.7 mt -79.85 -46.61 22.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.178 -0.465 . . . . 74.120000000000005 111.145 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 21.5 p30 -72.63 -8.69 56.53 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.175 -0.466 . . . . 74.519999999999996 110.865 179.848 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 62.86 43.02 99.54 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.73 -0.748 . . . . 44.32 112.497 -179.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 34.5 p-10 -88.51 -15.91 34.05 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.865 0.364 . . . . 52.020000000000003 110.869 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 104.14 2.35 45.03 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.768 -0.729 . . . . 64.150000000000006 112.468 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 5.3 tt0 -149.21 172.29 15.08 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.814 0.34 . . . . 61.219999999999999 110.913 -179.902 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 136' ' ' VAL . . . . . 0.659 HG22 ' HB3' ' A' ' 128' ' ' ALA . 72.4 t -106.83 109.28 27.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.185 -0.462 . . . . 62.219999999999999 111.111 179.977 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 20.9 p30 -91.27 164.79 13.75 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.159 -0.473 . . . . 50.240000000000002 110.859 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . 0.583 ' O ' HG23 ' A' ' 142' ' ' VAL . 37.5 t80 -52.25 -46.22 65.68 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.185 -0.462 . . . . 65.409999999999997 110.923 -179.97 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -51.91 -39.74 59.58 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.117 -0.492 . . . . 72.239999999999995 110.868 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 26.1 mt-10 -78.38 -37.36 44.32 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.172 -0.467 . . . . 52.530000000000001 110.887 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 36.8 t80 -63.95 -39.61 94.55 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.135 -0.484 . . . . 64.409999999999997 110.855 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . 0.583 HG23 ' O ' ' A' ' 138' ' ' TYR . 90.9 t -63.74 -50.72 76.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.175 -0.466 . . . . 61.0 111.119 -179.996 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . 0.548 ' HA ' HG22 ' A' ' 146' ' ' THR . 43.3 tt0 -70.8 -23.38 62.36 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.181 -0.463 . . . . 73.230000000000004 110.927 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 11.7 tpt -75.03 -18.73 60.29 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.157 -0.474 . . . . 72.200000000000003 110.904 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 145' ' ' MET . . . . . 0.499 ' HE2' ' HA ' ' M' ' 20' ' ' ARG . 5.8 ttm -98.2 -32.98 11.3 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.225 -0.443 . . . . 72.019999999999996 110.856 179.954 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 146' ' ' THR . . . . . 0.548 HG22 ' HA ' ' A' ' 143' ' ' GLN . 5.0 t -73.38 -24.02 60.26 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.256 -0.429 . . . . 35.210000000000001 111.128 -179.918 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -100.27 -75.43 0.58 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.239 -0.437 . . . . 51.43 111.1 179.854 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.348 0 CA-C-N 116.246 -0.434 . . . . 72.349999999999994 110.881 179.959 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' M' M ' 8' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.231 0.131 0 CA-C-O 120.852 0.358 . . . . 64.450000000000003 110.913 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' M' M ' 9' ' ' SER . . . . . . . . . . . . . 2.8 t -156.5 157.67 35.86 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.202 -0.453 . . . . 74.420000000000002 110.879 -179.937 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' M' M ' 10' ' ' GLY . . . . . . . . . . . . . . . -69.4 -28.69 72.24 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.744 -0.741 . . . . 75.239999999999995 112.514 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' M' M ' 11' ' ' GLY . . . . . . . . . . . . . . . -90.61 -159.92 36.06 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.719 -0.753 . . . . 53.329999999999998 112.475 -179.923 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' M' M ' 12' ' ' GLU . . . . . . . . . . . . . 47.0 tp10 53.98 89.06 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.878 0.371 . . . . 64.420000000000002 110.862 -179.848 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' M' M ' 13' ' ' LEU . . . . . 0.51 HD22 ' HB3' ' M' ' 15' ' ' LYS . 1.6 tt -88.5 121.26 30.69 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.16 -0.473 . . . . 61.450000000000003 110.919 179.996 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' M' M ' 14' ' ' ASP . . . . . 0.455 ' N ' HD23 ' M' ' 13' ' ' LEU . 10.3 t70 -98.06 61.31 1.5 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.178 -0.464 . . . . 73.120000000000005 110.873 179.844 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' M' M ' 15' ' ' LYS . . . . . 0.51 ' HB3' HD22 ' M' ' 13' ' ' LEU . 0.4 OUTLIER -79.18 -22.92 44.28 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.182 -0.463 . . . . 74.219999999999999 110.939 179.988 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' M' M ' 16' ' ' TRP . . . . . 0.581 ' CZ3' HD12 ' M' ' 19' ' ' ILE . 3.1 m95 -51.94 -38.59 57.04 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.222 -0.445 . . . . 72.540000000000006 110.865 179.908 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' M' M ' 17' ' ' GLU . . . . . . . . . . . . . 58.4 tt0 -56.07 -30.91 62.68 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.251 -0.431 . . . . 73.209999999999994 110.944 -179.959 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' M' M ' 18' ' ' LYS . . . . . . . . . . . . . 6.5 tppt? -52.02 -30.41 25.28 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.13 -0.486 . . . . 72.519999999999996 110.892 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' M' M ' 19' ' ' ILE . . . . . 0.581 HD12 ' CZ3' ' M' ' 16' ' ' TRP . 64.1 mt -91.31 -24.54 5.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.167 -0.47 . . . . 74.200000000000003 111.088 179.901 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' M' M ' 20' ' ' ARG . . . . . 0.499 ' HA ' ' HE2' ' A' ' 145' ' ' MET . 12.1 ttm180 -66.87 -25.83 66.6 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.204 -0.453 . . . . 72.099999999999994 110.835 -179.976 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' M' M ' 21' ' ' LEU . . . . . . . . . . . . . 46.9 mt 60.75 -173.86 0.12 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.213 -0.449 . . . . 62.219999999999999 110.919 -179.931 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' M' M ' 22' ' ' ARG . . . . . . . . . . . . . 8.6 mpt_? -104.8 144.23 28.3 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-O 121.579 0.704 . . . . 75.25 110.865 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' M' M ' 23' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.76 -176.81 1.61 Allowed 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.663 2.242 . . . . 45.409999999999997 112.354 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' M' M ' 24' ' ' GLY . . . . . . . . . . . . . . . 140.72 127.67 2.36 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.773 -0.727 . . . . 71.310000000000002 112.515 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' M' M ' 25' ' ' GLY . . . . . . . . . . . . . . . 164.82 -167.12 38.42 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.723 -0.751 . . . . 54.450000000000003 112.515 -179.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' M' M ' 26' ' ' LYS . . . . . . . . . . . . . 12.8 ptmt -63.13 -27.28 69.27 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.834 0.349 . . . . 71.400000000000006 110.898 179.998 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' M' M ' 27' ' ' LYS . . . . . . . . . . . . . 10.8 mttm 62.8 -172.87 0.16 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.243 -0.435 . . . . 73.120000000000005 110.874 179.844 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' M' M ' 28' ' ' GLN . . . . . . . . . . . . . 22.7 mm100 -75.93 -74.19 0.23 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.209 -0.45 . . . . 45.030000000000001 110.897 179.981 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' M' M ' 29' ' ' TYR . . . . . . . . . . . . . 13.7 m-85 -92.75 179.89 5.35 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.187 -0.461 . . . . 74.430000000000007 110.927 -179.841 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' M' M ' 30' ' ' LYS . . . . . . . . . . . . . 14.5 mtmm -101.89 -21.21 14.59 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.173 -0.467 . . . . 73.310000000000002 110.889 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' M' M ' 31' ' ' LEU . . . . . 0.495 HD11 ' HE3' ' A' ' 71' ' ' MET . 0.8 OUTLIER -96.99 -28.05 14.34 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.247 -0.433 . . . . 72.349999999999994 110.909 179.927 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' M' M ' 32' ' ' LYS . . . . . . . . . . . . . 7.5 tttp -49.2 -46.42 45.67 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.205 -0.452 . . . . 65.450000000000003 110.889 179.825 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' M' M ' 33' ' ' HIS . . . . . . . . . . . . . 22.1 t-160 -50.95 -37.18 42.87 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.239 -0.437 . . . . 72.239999999999995 110.842 179.91 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' M' M ' 34' ' ' ILE . . . . . . . . . . . . . 47.6 mm -50.33 -39.57 17.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.221 -0.445 . . . . 75.0 111.157 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' M' M ' 35' ' ' VAL . . . . . 0.585 HG11 ' HE3' ' A' ' 72' ' ' MET . 46.9 t -48.86 -40.18 12.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.131 -0.486 . . . . 72.140000000000001 111.132 179.818 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' M' M ' 36' ' ' TRP . . . . . . . . . . . . . 23.6 m0 -58.62 -39.91 81.82 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.177 -0.465 . . . . 74.319999999999993 110.956 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' M' M ' 37' ' ' ALA . . . . . 0.996 ' HB3' HD13 ' A' ' 39' ' ' LEU . . . -63.69 -18.66 64.21 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.198 -0.455 . . . . 73.230000000000004 111.141 179.845 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' M' M ' 38' ' ' SER . . . . . . . . . . . . . 13.2 m -69.48 -17.95 63.66 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.199 -0.455 . . . . 65.099999999999994 110.876 -179.811 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' M' M ' 39' ' ' ARG . . . . . . . . . . . . . 25.8 mmm180 -63.11 -24.18 67.78 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.122 -0.49 . . . . 73.430000000000007 110.831 -179.916 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' M' M ' 40' ' ' GLU . . . . . . . . . . . . . 17.3 tt0 -80.72 -48.07 13.07 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.212 -0.449 . . . . 73.400000000000006 110.905 -179.946 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' M' M ' 41' ' ' LEU . . . . . 0.655 HD11 ' OG ' ' A' ' 38' ' ' SER . 19.7 mt -52.36 170.3 0.07 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.168 -0.469 . . . . 74.299999999999997 110.913 -179.992 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' M' M ' 42' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -67.39 129.87 41.28 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.177 -0.465 . . . . 74.230000000000004 110.843 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' M' M ' 43' ' ' ARG . . . . . . . . . . . . . 18.3 ttt180 . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 116.123 -0.489 . . . . 64.310000000000002 110.844 -179.923 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 241' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 262' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 301' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 322' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.112 0 CA-C-O 120.764 0.316 . . . . 45.100000000000001 111.106 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -108.31 -66.78 1.01 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.22 -0.446 . . . . 72.239999999999995 110.899 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 47.3 mt-30 -84.7 176.83 8.31 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.206 -0.452 . . . . 73.349999999999994 110.925 -179.941 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.495 HD22 ' HG2' ' A' ' 8' ' ' GLN . 10.8 mt -126.33 151.63 47.31 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.171 -0.468 . . . . 62.43 110.884 -179.976 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 61.6 p -115.86 176.39 5.11 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.165 -0.47 . . . . 73.519999999999996 111.201 179.912 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 21.2 tt0 -55.76 -29.22 59.26 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.238 -0.437 . . . . 72.150000000000006 110.941 179.986 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -67.17 -37.58 83.96 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.11 -0.495 . . . . 62.030000000000001 110.876 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . 0.495 ' HG2' HD22 ' A' ' 4' ' ' LEU . 28.5 tp60 -77.84 -42.47 33.52 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.125 -0.489 . . . . 73.120000000000005 110.915 -179.913 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 54.3 mt -69.16 -37.25 76.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.205 -0.452 . . . . 60.520000000000003 111.114 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -51.95 -39.06 58.65 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.161 -0.472 . . . . 73.340000000000003 111.12 179.796 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 56.8 mt-10 -72.64 -52.03 17.06 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.234 -0.439 . . . . 73.420000000000002 110.89 -179.917 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.531 ' HB3' HD13 ' A' ' 69' ' ' LEU . 30.4 m-85 -55.96 -39.6 71.99 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.151 -0.477 . . . . 74.319999999999993 110.861 -179.913 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.14 -31.35 65.25 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.109 -0.496 . . . . 43.130000000000003 110.883 -179.985 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 24.4 tt0 -72.27 -30.71 65.11 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.231 -0.44 . . . . 63.32 110.879 179.966 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -72.77 -35.04 67.35 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.162 -0.472 . . . . 65.230000000000004 111.115 179.92 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 91.5 t80 -75.63 -51.99 11.58 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.213 -0.449 . . . . 73.319999999999993 110.87 -179.874 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 14.8 t -52.03 -31.79 31.42 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.158 -0.474 . . . . 75.450000000000003 110.845 -179.79 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.533 HD23 ' HB3' ' M' ' 38' ' ' SER . 15.9 tp -64.05 -47.11 81.46 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.071 -0.513 . . . . 65.019999999999996 110.911 -179.954 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.566 ' CD1' HG11 ' A' ' 35' ' ' VAL . 17.2 m-85 -69.79 -24.82 63.55 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.183 -0.462 . . . . 73.400000000000006 110.848 179.972 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 21.2 t0 -86.59 98.58 11.17 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.184 -0.462 . . . . 71.040000000000006 110.812 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.763 ' HE2' HG22 ' A' ' 35' ' ' VAL . 5.0 mptp? -71.23 -55.51 7.95 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.166 -0.47 . . . . 62.229999999999997 110.85 -179.99 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 23.1 p-10 -71.12 -10.25 59.43 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.249 -0.432 . . . . 71.510000000000005 110.833 179.892 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 51.49 40.6 47.21 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.746 -0.74 . . . . 54.219999999999999 112.522 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 21.1 p-10 -88.31 -15.7 35.04 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.878 0.37 . . . . 74.319999999999993 110.909 -179.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 104.64 -11.69 50.17 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.72 -0.752 . . . . 73.230000000000004 112.518 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 5.0 p -129.05 130.67 46.86 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.739 0.305 . . . . 44.520000000000003 111.182 -179.896 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 24.8 mt -96.83 128.64 47.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.244 -0.434 . . . . 74.510000000000005 111.149 179.933 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 32.2 p -108.31 -177.5 3.34 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.159 -0.473 . . . . 73.510000000000005 111.187 179.945 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.41 ' HB ' HD13 ' A' ' 48' ' ' LEU . 39.2 p -64.6 -37.32 87.15 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.259 -0.428 . . . . 73.349999999999994 111.141 -179.958 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 6.0 mmmm -71.99 -49.92 33.12 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.176 -0.466 . . . . 63.130000000000003 110.894 179.891 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 68.8 mt-10 -60.47 -36.61 78.67 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.212 -0.449 . . . . 75.439999999999998 110.879 179.985 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.2 tt -74.28 -55.63 5.81 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.131 -0.486 . . . . 75.340000000000003 110.931 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -52.08 -28.03 24.4 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.76 -0.734 . . . . 24.100000000000001 112.479 179.878 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 95.8 m -65.76 -54.51 26.14 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.767 0.318 . . . . 60.140000000000001 111.146 -179.889 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.763 HG22 ' HE2' ' A' ' 21' ' ' LYS . 42.7 t -55.98 -50.22 70.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.275 -0.421 . . . . 71.549999999999997 111.107 179.926 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -51.99 -38.06 55.37 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.177 -0.465 . . . . 64.120000000000005 110.853 179.915 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 32.7 ttm-85 -53.5 -52.89 58.12 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.277 -0.42 . . . . 74.439999999999998 110.872 -179.903 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . 0.59 ' OG ' HD21 ' M' ' 41' ' ' LEU . 3.1 t -64.76 -26.56 68.41 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.199 -0.455 . . . . 54.200000000000003 110.864 -179.826 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.98 HD13 ' HB3' ' M' ' 37' ' ' ALA . 61.9 mt -79.45 -18.6 51.78 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.152 -0.477 . . . . 72.030000000000001 110.958 -179.994 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 101.45 28.24 6.83 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.746 -0.74 . . . . 53.530000000000001 112.458 179.88 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 48.4 mm-40 -125.09 129.88 51.12 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.819 0.342 . . . . 60.109999999999999 110.908 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 39.2 t30 -109.86 80.02 1.61 Allowed Pre-proline 0 C--N 1.33 -0.28 0 CA-C-O 121.602 0.715 . . . . 72.319999999999993 110.896 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.7 147.94 64.37 Favored 'Trans proline' 0 C--O 1.231 0.174 0 C-N-CA 122.724 2.283 . . . . 75.0 112.346 179.913 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 21.3 p -96.01 162.56 13.5 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.209 -0.45 . . . . 72.540000000000006 111.189 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 20.7 tt0 -55.28 -44.39 75.61 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.26 -0.427 . . . . 74.430000000000007 110.846 -179.951 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.25 -31.73 64.28 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.186 -0.461 . . . . 53.039999999999999 111.094 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 78.4 tt0 -66.46 -49.29 67.16 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.246 -0.434 . . . . 75.099999999999994 110.92 -179.95 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.41 HD13 ' HB ' ' A' ' 29' ' ' THR . 14.8 mt -55.15 -51.68 65.7 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.158 -0.474 . . . . 70.019999999999996 110.95 -179.991 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 15.9 tp60 -55.01 -28.93 55.84 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.196 -0.456 . . . . 65.439999999999998 110.933 179.92 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -72.89 -40.05 65.9 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.182 -0.463 . . . . 73.219999999999999 110.825 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 38.2 mtp -76.36 -25.26 54.46 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.206 -0.452 . . . . 61.539999999999999 110.868 -179.995 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 80.3 mt -79.67 -40.64 21.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.259 -0.428 . . . . 72.420000000000002 111.14 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 49.2 m-20 -60.16 -48.8 80.21 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.178 -0.464 . . . . 62.009999999999998 110.905 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 18.0 pt-20 -55.7 -27.07 48.36 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.121 -0.49 . . . . 62.399999999999999 110.911 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.584 HG11 HD23 ' M' ' 31' ' ' LEU . 32.4 m -108.34 11.71 8.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.151 -0.477 . . . . 63.100000000000001 111.166 179.955 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 26.9 t0 -90.03 98.13 11.59 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.149 -0.478 . . . . 45.420000000000002 110.863 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.28 -46.25 9.37 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.206 -0.452 . . . . 63.020000000000003 111.13 179.931 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 10.2 p-10 -81.66 -0.19 41.49 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.196 -0.456 . . . . 75.019999999999996 110.863 179.96 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 53.65 56.5 19.93 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.718 -0.753 . . . . 53.229999999999997 112.508 -179.928 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 49.6 p-10 -114.51 -15.82 11.98 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.845 0.355 . . . . 73.430000000000007 110.861 -179.857 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 91.93 17.41 47.9 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.755 -0.736 . . . . 72.340000000000003 112.477 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 20.4 p -145.54 168.37 20.76 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.793 0.33 . . . . 73.430000000000007 111.11 -179.876 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 16.9 mt -106.72 109.49 28.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.163 -0.471 . . . . 60.109999999999999 111.133 179.927 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -76.9 -172.97 2.5 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.167 -0.469 . . . . 70.340000000000003 110.852 179.864 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.535 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 2.5 t80 -65.58 -58.43 11.77 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-O 121.667 0.746 . . . . 73.150000000000006 110.92 -179.936 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . 0.535 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 54.2 Cg_endo -69.75 -24.98 29.11 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.658 2.239 . . . . 73.120000000000005 112.365 179.949 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 22.7 mt-10 -63.66 -40.67 97.41 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.237 -0.438 . . . . 63.5 110.914 -179.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 34.3 t80 -74.02 -36.28 64.45 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.161 -0.472 . . . . 64.310000000000002 110.883 -179.945 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.531 HD13 ' HB3' ' A' ' 12' ' ' PHE . 50.1 tp -70.64 -53.9 14.03 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.171 -0.468 . . . . 72.019999999999996 110.949 179.981 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 13.1 t -55.64 -26.55 45.01 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.178 -0.465 . . . . 73.549999999999997 111.126 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 9.1 tmm? -62.83 -39.61 94.84 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.197 -0.456 . . . . 64.120000000000005 110.892 179.913 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -79.76 -40.02 29.7 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.22 -0.445 . . . . 72.310000000000002 110.938 179.918 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -66.75 -34.86 78.77 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.184 -0.462 . . . . 74.239999999999995 111.085 179.9 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 15.2 ttp180 -58.41 -24.64 60.65 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.217 -0.447 . . . . 60.329999999999998 110.856 -179.847 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 39.7 tttm -74.8 -6.5 49.34 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.218 -0.446 . . . . 74.319999999999993 110.927 179.924 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 18.5 ptm -51.3 -30.83 19.4 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.179 -0.464 . . . . 72.530000000000001 110.916 179.848 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 3.3 tppp? -174.7 -74.82 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.192 -0.458 . . . . 64.030000000000001 110.838 179.931 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 36.5 t70 -71.7 113.6 8.91 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.245 -0.434 . . . . 71.040000000000006 110.889 179.87 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . 0.58 HG23 ' H ' ' M' ' 27' ' ' LYS . 10.4 t -166.41 28.15 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.199 -0.455 . . . . 53.219999999999999 111.12 -179.893 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -125.56 8.02 7.64 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.235 -0.439 . . . . 73.519999999999996 110.866 179.952 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . 0.624 ' O ' HD12 ' A' ' 85' ' ' ILE . 33.7 p -77.86 -52.58 8.66 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.167 -0.47 . . . . 74.239999999999995 110.86 -179.74 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 11.8 mm-40 -72.18 -42.08 66.26 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.122 -0.49 . . . . 75.329999999999998 110.868 -179.948 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -53.47 -28.41 30.43 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.177 -0.465 . . . . 73.430000000000007 110.89 -179.928 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 2.9 tm-20 -69.88 -50.94 37.49 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.127 -0.488 . . . . 74.140000000000001 110.914 -179.906 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.753 HG21 HG22 ' A' ' 142' ' ' VAL . 3.1 mp -70.43 -50.97 41.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.13 -0.486 . . . . 70.310000000000002 111.148 179.95 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 41.8 ttm-85 -54.69 -28.15 45.58 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.151 -0.477 . . . . 74.010000000000005 110.885 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.726 ' O ' HG23 ' A' ' 91' ' ' VAL . 7.9 tm-20 -74.94 -58.52 3.23 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.177 -0.465 . . . . 71.400000000000006 110.866 -179.948 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . 0.74 ' HB1' ' CE2' ' A' ' 92' ' ' PHE . . . -58.83 -43.31 90.63 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.177 -0.465 . . . . 64.230000000000004 111.129 179.922 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 4.1 t80 -52.01 -48.11 64.63 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.166 -0.47 . . . . 64.540000000000006 110.925 -179.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.22 -26.19 64.68 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.13 -0.486 . . . . 72.299999999999997 110.905 -179.95 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . 0.726 HG23 ' O ' ' A' ' 87' ' ' GLU . 93.0 t -77.36 -27.31 15.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.16 -0.473 . . . . 61.219999999999999 111.133 179.974 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.74 ' CE2' ' HB1' ' A' ' 88' ' ' ALA . 18.2 m-85 -94.77 -28.48 15.25 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.174 -0.466 . . . . 75.540000000000006 110.872 -179.946 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 34.6 t0 -66.9 95.86 0.39 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.12 -0.491 . . . . 74.519999999999996 110.888 179.981 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 71.1 mmtt -78.73 -52.26 8.63 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.201 -0.454 . . . . 55.140000000000001 110.899 179.997 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 10.2 p30 -72.32 -9.2 58.18 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.193 -0.458 . . . . 74.299999999999997 110.838 179.886 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 59.19 26.22 61.07 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.733 -0.746 . . . . 72.200000000000003 112.518 -179.923 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 35.7 p-10 -81.75 -16.16 51.99 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.91 0.386 . . . . 74.340000000000003 110.895 -179.878 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 87.05 18.71 57.34 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.742 -0.742 . . . . 70.400000000000006 112.506 -179.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 19.7 m-85 -141.96 146.55 35.76 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.834 0.349 . . . . 72.209999999999994 110.948 -179.791 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.556 HD12 ' CD2' ' A' ' 141' ' ' PHE . 62.1 mt -112.89 127.47 70.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.108 -0.496 . . . . 74.030000000000001 111.178 179.87 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 96.3 p -112.75 -172.59 2.08 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.163 -0.471 . . . . 73.439999999999998 110.835 -179.876 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . 0.472 ' O ' HG11 ' A' ' 121' ' ' VAL . . . -65.4 -34.14 77.61 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.129 -0.487 . . . . 70.310000000000002 111.095 179.914 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -70.4 -49.89 44.27 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.213 -0.449 . . . . 53.439999999999998 111.064 179.934 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . 0.53 ' O ' HG23 ' A' ' 108' ' ' VAL . 21.5 mt-10 -62.24 -50.21 72.67 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.243 -0.435 . . . . 73.120000000000005 110.853 -179.875 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.456 HD21 ' HB3' ' A' ' 124' ' ' MET . 12.0 tp -53.6 -52.46 59.73 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.151 -0.477 . . . . 62.240000000000002 110.946 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . 0.489 ' HB2' HG21 ' A' ' 121' ' ' VAL . 31.9 ttp180 -57.34 -42.29 81.69 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.158 -0.474 . . . . 64.230000000000004 110.855 179.949 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 50.3 t60 -60.34 -34.42 73.81 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.249 -0.432 . . . . 62.32 110.903 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.53 HG23 ' O ' ' A' ' 104' ' ' GLU . 95.8 t -71.53 -52.47 25.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.188 -0.46 . . . . 61.140000000000001 111.087 179.996 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . 0.688 ' HE3' ' HB3' ' M' ' 15' ' ' LYS . 5.6 tpp -62.69 -42.03 99.42 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.174 -0.467 . . . . 63.340000000000003 110.882 179.929 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . 0.452 HG23 ' O ' ' A' ' 106' ' ' ARG . 12.8 p -53.84 -36.62 62.77 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.255 -0.429 . . . . 63.119999999999997 111.138 -179.933 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 87.9 m-20 -61.13 -30.24 70.25 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.248 -0.433 . . . . 64.129999999999995 110.893 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.745 HD13 ' HD3' ' M' ' 18' ' ' LYS . 23.5 mt -70.75 -23.38 62.42 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.168 -0.469 . . . . 72.439999999999998 110.914 179.988 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 101.02 32.98 5.12 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.77 -0.729 . . . . 54.5 112.509 179.901 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 34.9 tp10 -111.65 111.02 21.72 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.934 0.397 . . . . 71.409999999999997 110.922 -179.905 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 5.8 ptpp? -60.67 127.79 33.41 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.116 -0.493 . . . . 71.420000000000002 110.845 -179.985 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.468 HD21 ' HD3' ' M' ' 15' ' ' LYS . 30.5 mt -146.75 162.5 38.42 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.235 -0.438 . . . . 74.010000000000005 110.928 179.895 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 33.1 p -118.68 159.87 22.87 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.167 -0.47 . . . . 74.540000000000006 111.177 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -52.24 -39.58 60.49 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.217 -0.447 . . . . 71.340000000000003 110.857 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -72.48 -33.37 66.94 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.187 -0.46 . . . . 70.329999999999998 110.877 -179.893 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 65.4 tt0 -66.34 -39.21 89.05 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.15 -0.477 . . . . 71.329999999999998 110.888 -179.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.489 HG21 ' HB2' ' A' ' 106' ' ' ARG . 89.4 t -62.62 -34.24 64.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.158 -0.474 . . . . 73.310000000000002 111.133 179.982 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -51.97 -45.34 64.4 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.205 -0.452 . . . . 70.040000000000006 110.854 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 17.9 tp10 -56.62 -29.34 62.08 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.21 -0.45 . . . . 74.25 110.893 -179.915 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . 0.474 ' HE1' ' HB2' ' M' ' 15' ' ' LYS . 8.7 mtp -74.46 -56.98 4.24 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.178 -0.464 . . . . 73.319999999999993 110.923 179.971 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 34.7 mm -54.05 -35.57 29.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.23 -0.441 . . . . 75.109999999999999 111.097 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 16.3 tpt180 -65.85 -31.75 72.88 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.203 -0.453 . . . . 73.400000000000006 110.869 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -71.33 -48.82 48.0 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.196 -0.456 . . . . 74.040000000000006 110.903 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.646 ' HB3' HG22 ' A' ' 136' ' ' VAL . . . -71.75 -34.2 69.31 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.165 -0.47 . . . . 63.25 111.089 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 49.8 t0 -68.27 86.79 0.28 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.228 -0.442 . . . . 71.430000000000007 110.887 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 56.5 mt -79.94 -46.0 22.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.204 -0.453 . . . . 71.129999999999995 111.124 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 21.7 p30 -72.7 -8.73 56.8 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.17 -0.468 . . . . 63.509999999999998 110.906 179.822 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 62.84 43.38 99.02 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.725 -0.75 . . . . 63.509999999999998 112.499 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 34.5 p-10 -88.69 -16.01 33.41 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.818 0.342 . . . . 75.340000000000003 110.841 -179.941 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 103.87 2.45 45.96 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.759 -0.734 . . . . 43.520000000000003 112.476 -179.928 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 4.5 tt0 -149.2 172.26 15.13 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.82 0.343 . . . . 74.209999999999994 110.941 -179.913 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 136' ' ' VAL . . . . . 0.646 HG22 ' HB3' ' A' ' 128' ' ' ALA . 94.4 t -108.21 111.82 37.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.204 -0.453 . . . . 72.230000000000004 111.082 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 15.5 p30 -91.85 179.63 5.56 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.155 -0.475 . . . . 74.109999999999999 110.917 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . 0.694 ' O ' HG23 ' A' ' 142' ' ' VAL . 36.1 t80 -63.97 -47.65 79.57 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.194 -0.457 . . . . 75.120000000000005 110.927 -179.943 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 14.3 tt0 -52.04 -39.86 60.21 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.139 -0.482 . . . . 62.240000000000002 110.867 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -78.49 -42.46 29.62 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.221 -0.445 . . . . 63.450000000000003 110.898 -179.946 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . 0.556 ' CD2' HD12 ' A' ' 100' ' ' ILE . 24.4 t80 -58.93 -36.7 75.2 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.15 -0.477 . . . . 72.439999999999998 110.859 -179.959 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . 0.753 HG22 HG21 ' A' ' 85' ' ' ILE . 94.0 t -66.66 -44.85 89.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.184 -0.462 . . . . 70.099999999999994 111.119 179.995 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 31.1 tt0 -66.54 -42.94 86.41 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.207 -0.451 . . . . 75.319999999999993 110.91 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 33.6 tpp -65.11 -26.75 68.34 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.216 -0.447 . . . . 73.230000000000004 110.868 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 145' ' ' MET . . . . . 0.407 ' HE1' HG22 ' M' ' 19' ' ' ILE . 0.0 OUTLIER -84.37 -28.16 27.17 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.232 -0.44 . . . . 60.32 110.832 179.973 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 1.6 m -104.63 21.31 17.05 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.275 -0.42 . . . . 72.109999999999999 111.092 -179.886 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -67.79 102.11 1.18 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.229 -0.441 . . . . 72.230000000000004 111.088 179.896 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 18.6 mtpp . . . . . 0 C--N 1.328 -0.329 0 CA-C-N 116.239 -0.437 . . . . 75.319999999999993 110.947 179.94 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' M' M ' 8' ' ' LEU . . . . . . . . . . . . . 4.6 mm? . . . . . 0 C--O 1.231 0.08 0 CA-C-O 120.843 0.354 . . . . 73.040000000000006 110.896 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' M' M ' 9' ' ' SER . . . . . . . . . . . . . 8.3 t -145.66 -42.43 0.22 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.143 -0.48 . . . . 64.310000000000002 110.868 -179.945 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' M' M ' 10' ' ' GLY . . . . . . . . . . . . . . . -132.91 142.19 13.67 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.741 -0.742 . . . . 64.519999999999996 112.494 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' M' M ' 11' ' ' GLY . . . . . . . . . . . . . . . 168.1 -43.67 0.23 Allowed Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.731 -0.747 . . . . 63.240000000000002 112.447 -179.878 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' M' M ' 12' ' ' GLU . . . . . . . . . . . . . 15.8 mt-10 -66.27 115.74 6.57 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.926 0.393 . . . . 64.129999999999995 110.888 -179.872 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' M' M ' 13' ' ' LEU . . . . . 0.668 HD23 ' N ' ' M' ' 14' ' ' ASP . 2.7 tt -88.18 145.02 26.12 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.137 -0.483 . . . . 74.129999999999995 110.919 -179.969 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' M' M ' 14' ' ' ASP . . . . . 0.668 ' N ' HD23 ' M' ' 13' ' ' LEU . 8.7 t70 -51.3 -62.77 1.42 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.197 -0.456 . . . . 75.140000000000001 110.872 179.864 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' M' M ' 15' ' ' LYS . . . . . 0.688 ' HB3' ' HE3' ' A' ' 109' ' ' MET . 11.3 mttm -50.61 -49.72 55.89 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.207 -0.451 . . . . 75.519999999999996 110.871 179.99 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' M' M ' 16' ' ' TRP . . . . . 0.727 ' CE3' HD12 ' M' ' 19' ' ' ILE . 5.6 m95 -52.27 -42.97 64.15 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.231 -0.441 . . . . 75.319999999999993 110.909 179.921 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' M' M ' 17' ' ' GLU . . . . . . . . . . . . . 48.3 tt0 -58.37 -28.08 64.8 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.224 -0.443 . . . . 61.509999999999998 110.902 -179.942 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' M' M ' 18' ' ' LYS . . . . . 0.745 ' HD3' HD13 ' A' ' 112' ' ' LEU . 14.2 ttmm -68.36 -25.85 65.29 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.146 -0.479 . . . . 53.409999999999997 110.892 179.948 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' M' M ' 19' ' ' ILE . . . . . 0.727 HD12 ' CE3' ' M' ' 16' ' ' TRP . 33.5 mt -86.46 -13.2 10.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.23 -0.441 . . . . 64.310000000000002 111.131 179.865 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' M' M ' 20' ' ' ARG . . . . . . . . . . . . . 39.7 ttp180 -66.28 -39.66 89.56 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.178 -0.465 . . . . 70.219999999999999 110.897 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' M' M ' 21' ' ' LEU . . . . . . . . . . . . . 16.0 mt 53.63 -169.94 0.05 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.209 -0.451 . . . . 54.210000000000001 110.91 -180.0 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' M' M ' 22' ' ' ARG . . . . . . . . . . . . . 24.6 mtp85 -156.5 57.57 1.46 Allowed Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 121.629 0.728 . . . . 72.540000000000006 110.836 179.931 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' M' M ' 23' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.79 -171.1 0.44 Allowed 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.716 2.278 . . . . 72.530000000000001 112.376 179.961 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' M' M ' 24' ' ' GLY . . . . . . . . . . . . . . . -144.1 -109.96 0.7 Allowed Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.744 -0.741 . . . . 60.439999999999998 112.479 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' M' M ' 25' ' ' GLY . . . . . . . . . . . . . . . 81.22 -84.77 1.43 Allowed Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.726 -0.749 . . . . 53.25 112.457 -179.937 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' M' M ' 26' ' ' LYS . . . . . . . . . . . . . 13.8 ttpt 63.57 160.0 0.09 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.827 0.346 . . . . 61.109999999999999 110.921 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' M' M ' 27' ' ' LYS . . . . . 0.58 ' H ' HG23 ' A' ' 79' ' ' THR . 30.6 mmtp 58.46 -169.62 0.12 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.257 -0.429 . . . . 60.229999999999997 110.922 179.889 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' M' M ' 28' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER 63.69 106.17 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.244 -0.435 . . . . 70.340000000000003 110.936 179.954 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' M' M ' 29' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -113.52 -22.3 10.39 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.236 -0.438 . . . . 74.420000000000002 110.908 -179.865 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' M' M ' 30' ' ' LYS . . . . . . . . . . . . . 17.4 tttm 63.67 29.19 15.06 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.121 -0.491 . . . . 73.540000000000006 110.862 179.893 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' M' M ' 31' ' ' LEU . . . . . 0.584 HD23 HG11 ' A' ' 55' ' ' VAL . 10.1 tp -144.94 -52.16 0.28 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.256 -0.429 . . . . 62.420000000000002 110.934 179.941 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' M' M ' 32' ' ' LYS . . . . . . . . . . . . . 3.2 ptmm? -49.53 -36.18 22.63 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.188 -0.46 . . . . 75.519999999999996 110.9 179.824 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' M' M ' 33' ' ' HIS . . . . . . . . . . . . . 12.7 t-160 -49.74 -42.61 46.66 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.201 -0.454 . . . . 73.400000000000006 110.861 179.898 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' M' M ' 34' ' ' ILE . . . . . . . . . . . . . 55.1 mt -50.69 -38.69 17.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.201 -0.454 . . . . 73.409999999999997 111.145 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' M' M ' 35' ' ' VAL . . . . . . . . . . . . . 39.9 t -49.6 -39.54 14.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.139 -0.482 . . . . 75.120000000000005 111.166 179.859 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' M' M ' 36' ' ' TRP . . . . . . . . . . . . . 21.9 m0 -58.94 -39.29 81.18 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.196 -0.456 . . . . 71.239999999999995 110.926 179.966 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' M' M ' 37' ' ' ALA . . . . . 0.98 ' HB3' HD13 ' A' ' 39' ' ' LEU . . . -63.82 -18.64 64.33 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.226 -0.443 . . . . 52.020000000000003 111.091 179.88 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' M' M ' 38' ' ' SER . . . . . 0.533 ' HB3' HD23 ' A' ' 18' ' ' LEU . 0.9 OUTLIER -71.88 -17.96 62.08 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.193 -0.458 . . . . 75.420000000000002 110.843 -179.787 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' M' M ' 39' ' ' ARG . . . . . . . . . . . . . 60.1 mtt180 -56.48 -25.83 52.32 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.201 -0.454 . . . . 74.109999999999999 110.894 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' M' M ' 40' ' ' GLU . . . . . . . . . . . . . 22.7 tt0 -87.43 -47.99 8.33 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.205 -0.452 . . . . 75.200000000000003 110.905 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' M' M ' 41' ' ' LEU . . . . . 0.59 HD21 ' OG ' ' A' ' 38' ' ' SER . 11.7 mt -64.49 153.66 38.24 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.179 -0.464 . . . . 73.019999999999996 110.957 -179.993 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' M' M ' 42' ' ' GLU . . . . . . . . . . . . . 15.1 tp10 -103.85 -57.83 1.97 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.193 -0.458 . . . . 75.430000000000007 110.916 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' M' M ' 43' ' ' ARG . . . . . . . . . . . . . 47.7 ttt-85 . . . . . 0 C--N 1.329 -0.289 0 CA-C-N 116.133 -0.485 . . . . 65.340000000000003 110.892 -179.955 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 241' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 262' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 301' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 322' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.789 0.328 . . . . 54.229999999999997 111.108 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -126.21 158.86 34.55 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.231 -0.441 . . . . 54.32 110.899 179.93 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 32.8 mt-30 -67.5 -74.03 0.13 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.181 -0.463 . . . . 71.420000000000002 110.92 -179.914 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 11.2 mt -126.03 150.6 47.99 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.213 -0.449 . . . . 72.310000000000002 110.878 -179.984 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 17.3 p -119.12 171.73 8.07 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.139 -0.482 . . . . 64.450000000000003 111.152 179.911 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -55.44 -32.03 62.41 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.22 -0.445 . . . . 61.420000000000002 110.866 -179.971 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -66.97 -37.19 83.8 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.162 -0.472 . . . . 64.219999999999999 110.925 -179.959 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 7.0 tp60 -78.1 -41.45 35.19 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.127 -0.488 . . . . 74.030000000000001 110.898 -179.923 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 78.3 mt -69.35 -40.61 80.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.195 -0.457 . . . . 63.32 111.147 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -53.21 -31.4 42.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.133 -0.485 . . . . 63.539999999999999 111.105 179.787 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -74.12 -39.36 63.4 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.225 -0.443 . . . . 73.120000000000005 110.913 -179.924 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 24.7 m-85 -72.25 -45.89 58.28 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.189 -0.459 . . . . 72.239999999999995 110.918 -179.954 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 24.2 ttpp -67.45 -26.75 66.55 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.148 -0.478 . . . . 71.239999999999995 110.88 179.958 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -67.02 -38.64 86.29 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.256 -0.429 . . . . 75.120000000000005 110.866 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -64.01 -34.06 77.15 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.122 -0.49 . . . . 73.030000000000001 111.121 179.887 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 51.7 t80 -57.3 -53.87 53.18 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.224 -0.444 . . . . 65.200000000000003 110.832 -179.895 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.7 t -52.6 -29.66 27.08 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.175 -0.466 . . . . 54.530000000000001 110.843 -179.785 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 15.6 tp -67.12 -48.17 68.9 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.141 -0.481 . . . . 61.140000000000001 110.91 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 44.5 m-85 -71.78 -25.34 61.98 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.227 -0.442 . . . . 75.319999999999993 110.886 179.922 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 8.1 t0 -82.54 98.56 9.02 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.139 -0.482 . . . . 73.129999999999995 110.903 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.637 ' HE3' HG21 ' A' ' 34' ' ' THR . 21.7 ttmm -69.21 -53.46 19.84 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.206 -0.452 . . . . 61.340000000000003 110.888 179.999 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 9.7 p30 -76.78 -10.09 59.13 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.24 -0.436 . . . . 34.210000000000001 110.833 179.915 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 52.15 46.49 56.47 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.701 -0.761 . . . . 53.539999999999999 112.501 -179.942 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 38.4 p-10 -89.08 -12.47 41.11 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.845 0.355 . . . . 75.219999999999999 110.853 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 105.44 -11.69 47.18 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.72 -0.752 . . . . 64.319999999999993 112.477 -179.965 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 56.0 p -133.59 130.69 38.71 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.788 0.328 . . . . 72.409999999999997 111.125 -179.827 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.529 HD12 ' HB ' ' A' ' 63' ' ' ILE . 47.3 mt -84.45 125.7 40.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.193 -0.458 . . . . 75.439999999999998 111.123 179.908 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.434 HG22 ' CG2' ' A' ' 62' ' ' THR . 28.3 p -107.81 171.09 7.59 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.158 -0.474 . . . . 62.530000000000001 111.109 179.989 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 16.3 p -54.21 -45.02 72.14 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.158 -0.474 . . . . 75.109999999999999 111.187 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 4.9 tmtm? -60.14 -37.3 79.67 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.177 -0.465 . . . . 74.040000000000006 110.911 179.91 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.474 ' O ' HG23 ' A' ' 35' ' ' VAL . 39.4 mt-10 -74.0 -32.86 63.59 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.265 -0.425 . . . . 73.219999999999999 110.89 179.939 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.586 ' O ' HD13 ' A' ' 32' ' ' LEU . 0.9 OUTLIER -74.28 -39.98 62.59 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.169 -0.469 . . . . 73.420000000000002 110.892 -179.967 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -71.58 -38.03 61.78 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.735 -0.745 . . . . 52.509999999999998 112.537 179.87 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.637 HG21 ' HE3' ' A' ' 21' ' ' LYS . 96.1 m -62.79 -55.96 21.75 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.817 0.341 . . . . 72.420000000000002 111.185 -179.899 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.474 HG23 ' O ' ' A' ' 31' ' ' GLU . 71.4 t -54.63 -51.79 47.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.208 -0.451 . . . . 62.310000000000002 111.13 179.875 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 26.4 mtp -52.08 -31.51 30.71 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.205 -0.452 . . . . 71.340000000000003 110.884 179.91 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 45.4 ttp180 -63.37 -43.92 96.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.245 -0.434 . . . . 74.530000000000001 110.865 -179.912 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . 0.619 ' OG ' HD11 ' M' ' 41' ' ' LEU . 1.3 p -65.25 -34.22 77.85 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.163 -0.472 . . . . 51.549999999999997 110.85 -179.779 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.941 HD13 ' HB3' ' M' ' 37' ' ' ALA . 32.1 mt -72.11 -19.84 61.73 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.176 -0.465 . . . . 74.319999999999993 110.892 179.971 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 101.46 30.07 6.05 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.772 -0.728 . . . . 73.200000000000003 112.52 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 83.9 mm-40 -118.64 132.59 56.18 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.798 0.332 . . . . 55.299999999999997 110.928 -179.93 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 33.5 t-20 -109.88 76.63 0.98 Allowed Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.618 0.723 . . . . 64.430000000000007 110.864 -179.9 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.422 ' CG ' HD21 ' A' ' 48' ' ' LEU . 53.6 Cg_endo -69.73 164.65 33.73 Favored 'Trans proline' 0 C--N 1.341 0.17 0 C-N-CA 122.69 2.26 . . . . 73.230000000000004 112.36 179.94 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 19.6 p -112.93 166.41 11.42 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.211 -0.45 . . . . 65.109999999999999 111.172 179.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -59.17 -42.26 90.4 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.229 -0.441 . . . . 75.150000000000006 110.891 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.23 -31.58 64.23 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.153 -0.476 . . . . 44.43 111.079 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -71.88 -52.1 19.01 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.212 -0.449 . . . . 61.350000000000001 110.893 -179.92 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.422 HD21 ' CG ' ' A' ' 43' ' ' PRO . 18.8 mt -56.09 -51.78 66.64 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.16 -0.473 . . . . 74.439999999999998 110.953 179.985 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 28.6 tp60 -52.85 -29.19 26.52 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.174 -0.466 . . . . 62.43 110.935 179.931 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -75.5 -43.4 49.32 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.213 -0.449 . . . . 72.239999999999995 110.892 179.915 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . 0.437 ' HE1' HD13 ' M' ' 31' ' ' LEU . 68.2 mtp -58.31 -58.04 10.26 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.149 -0.478 . . . . 74.040000000000006 110.891 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 79.6 mt -55.89 -42.06 69.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.19 -0.459 . . . . 63.340000000000003 111.115 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 63.4 m-20 -60.51 -31.28 70.34 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.15 -0.477 . . . . 73.209999999999994 110.877 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -71.26 -23.29 61.95 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.196 -0.456 . . . . 75.010000000000005 110.912 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.56 HG13 ' CE1' ' M' ' 29' ' ' TYR . 2.9 m -114.0 10.87 8.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.15 -0.477 . . . . 34.509999999999998 111.135 179.973 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 23.2 t0 -90.16 97.67 11.32 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.156 -0.475 . . . . 72.340000000000003 110.868 179.943 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.29 -44.27 10.94 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.247 -0.433 . . . . 60.219999999999999 111.106 179.946 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 6.4 p-10 -83.09 -0.22 48.07 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.205 -0.452 . . . . 73.030000000000001 110.865 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 51.6 57.38 12.29 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.712 -0.756 . . . . 62.200000000000003 112.485 -179.952 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 53.1 p-10 -114.56 -15.72 11.97 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.853 0.359 . . . . 55.32 110.845 -179.848 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 89.28 17.81 54.62 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.771 -0.728 . . . . 72.230000000000004 112.459 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . 0.434 ' CG2' HG22 ' A' ' 28' ' ' THR . 28.5 p -150.15 158.67 44.4 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.74 0.305 . . . . 75.530000000000001 111.145 -179.868 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.529 ' HB ' HD12 ' A' ' 27' ' ' ILE . 7.6 mm -94.6 110.12 23.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.267 -0.424 . . . . 71.549999999999997 111.14 179.924 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -77.47 -172.79 2.65 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.151 -0.477 . . . . 75.349999999999994 110.837 179.9 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.537 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 2.5 t80 -64.59 -58.31 13.92 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.621 0.724 . . . . 73.319999999999993 110.852 -179.942 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . 0.537 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 54.2 Cg_endo -69.76 -29.9 23.13 Favored 'Trans proline' 0 N--CA 1.465 -0.159 0 C-N-CA 122.698 2.265 . . . . 63.409999999999997 112.372 -179.981 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 11.5 mt-10 -57.17 -41.63 79.63 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.177 -0.465 . . . . 73.450000000000003 110.865 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 5.7 t80 -72.77 -36.12 67.58 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.166 -0.47 . . . . 72.099999999999994 110.845 -179.898 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 19.2 tp -65.42 -53.76 38.33 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.139 -0.482 . . . . 74.519999999999996 110.91 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 9.4 t -55.24 -28.38 52.83 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.212 -0.449 . . . . 53.200000000000003 111.157 179.944 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 6.2 tmm? -68.12 -40.07 82.58 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.181 -0.463 . . . . 52.219999999999999 110.897 179.911 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . 0.471 ' HE2' HG11 ' M' ' 35' ' ' VAL . 0.0 OUTLIER -79.85 -33.57 40.06 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.194 -0.457 . . . . 65.219999999999999 110.861 179.967 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -74.91 -33.68 62.05 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.22 -0.446 . . . . 63.310000000000002 111.075 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 6.1 ttt85 -60.54 -20.26 59.73 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.215 -0.448 . . . . 71.209999999999994 110.939 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 20.7 ttpp -51.59 -30.11 19.86 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.161 -0.472 . . . . 71.040000000000006 110.86 179.985 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 7.2 ttm -53.3 -54.54 34.91 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.257 -0.429 . . . . 65.5 110.855 179.917 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -157.48 164.03 37.84 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.226 -0.443 . . . . 61.109999999999999 110.91 179.952 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 26.5 t0 63.25 75.92 0.38 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.244 -0.435 . . . . 64.340000000000003 110.863 179.825 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . 0.646 HG23 ' HG2' ' M' ' 27' ' ' LYS . 2.0 t 179.23 73.04 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.18 -0.464 . . . . 71.420000000000002 111.152 -179.842 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -179.18 -41.56 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.242 -0.435 . . . . 70.349999999999994 110.857 179.958 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 1.9 t -52.1 -47.19 65.38 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.177 -0.465 . . . . 72.010000000000005 110.904 -179.78 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -52.04 -59.92 3.8 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.128 -0.487 . . . . 73.120000000000005 110.914 -179.961 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 14.3 tp10 -58.68 -35.72 73.05 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.145 -0.48 . . . . 72.010000000000005 110.929 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 13.2 tp10 -61.35 -39.76 91.78 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.109 -0.496 . . . . 75.420000000000002 110.896 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.512 HD13 HG13 ' A' ' 142' ' ' VAL . 53.2 mt -75.03 -49.49 28.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.158 -0.473 . . . . 52.420000000000002 111.134 179.971 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 12.2 ttt180 -62.21 -28.33 69.61 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.146 -0.479 . . . . 63.399999999999999 110.858 179.977 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.731 ' O ' HG23 ' A' ' 91' ' ' VAL . 11.3 mm-40 -70.21 -58.38 3.84 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.221 -0.445 . . . . 75.409999999999997 110.91 -179.976 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . 0.621 ' HB1' ' CE2' ' A' ' 92' ' ' PHE . . . -54.29 -45.39 72.5 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.095 -0.502 . . . . 42.149999999999999 111.107 179.916 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 6.7 t80 -52.06 -51.33 58.24 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.211 -0.449 . . . . 74.230000000000004 110.909 -179.935 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 13.2 ttt85 -61.68 -40.52 95.26 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.121 -0.49 . . . . 70.099999999999994 110.869 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . 0.731 HG23 ' O ' ' A' ' 87' ' ' GLU . 39.0 t -59.45 -51.15 76.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.214 -0.448 . . . . 75.209999999999994 111.137 179.99 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.621 ' CE2' ' HB1' ' A' ' 88' ' ' ALA . 11.8 m-85 -68.56 -29.04 67.51 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.159 -0.473 . . . . 73.319999999999993 110.838 -179.972 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 33.1 t0 -70.45 94.09 0.94 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.158 -0.473 . . . . 62.009999999999998 110.881 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 2.6 mptm? -78.67 -52.09 8.92 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.215 -0.448 . . . . 75.420000000000002 110.869 -179.962 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 47.6 p30 -72.5 -9.17 58.23 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.219 -0.446 . . . . 64.209999999999994 110.895 179.86 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 59.95 28.71 66.54 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.7 -0.762 . . . . 64.109999999999999 112.521 -179.924 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 45.3 p-10 -82.39 -16.25 49.77 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.882 0.372 . . . . 73.349999999999994 110.896 -179.882 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 88.56 18.66 54.49 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.717 -0.754 . . . . 42.310000000000002 112.452 179.991 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 13.4 m-85 -136.03 159.41 41.78 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.841 0.353 . . . . 72.450000000000003 110.949 -179.827 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.419 HG21 HD13 ' A' ' 105' ' ' LEU . 71.4 mt -122.04 120.84 62.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.119 -0.491 . . . . 74.530000000000001 111.159 179.87 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 4.9 p -114.9 175.0 5.69 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.189 -0.46 . . . . 71.409999999999997 110.864 -179.905 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -66.15 -25.17 66.84 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.119 -0.491 . . . . 55.030000000000001 111.064 179.927 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -71.07 -49.94 39.22 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.228 -0.442 . . . . 75.200000000000003 111.125 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -76.97 -48.05 19.11 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.228 -0.442 . . . . 75.329999999999998 110.899 -179.965 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.525 HD21 ' CE ' ' A' ' 124' ' ' MET . 19.0 tp -53.14 -40.45 64.27 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.155 -0.475 . . . . 73.129999999999995 110.907 -179.957 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 41.6 ttp180 -56.49 -49.43 74.71 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.155 -0.475 . . . . 71.310000000000002 110.894 179.938 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 6.2 t60 -54.28 -36.46 63.68 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.171 -0.468 . . . . 73.230000000000004 110.818 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 85.7 t -63.53 -51.66 67.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.219 -0.446 . . . . 72.129999999999995 111.129 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . 0.767 ' HE2' HD11 ' M' ' 19' ' ' ILE . 5.4 mmt -60.58 -26.02 66.64 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.239 -0.437 . . . . 75.439999999999998 110.866 179.931 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 1.6 m -66.77 -45.2 79.28 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.206 -0.452 . . . . 43.240000000000002 111.164 -179.956 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 5.6 t30 -55.29 -30.62 60.52 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.245 -0.434 . . . . 63.240000000000002 110.868 179.973 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.742 HD12 ' HA ' ' A' ' 109' ' ' MET . 7.8 mt -75.42 -25.41 57.5 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.227 -0.442 . . . . 71.120000000000005 110.945 179.949 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 101.02 32.98 5.12 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.706 -0.759 . . . . 71.340000000000003 112.487 179.866 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -124.25 109.96 14.04 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.873 0.368 . . . . 74.310000000000002 110.865 -179.8 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 19.2 mmtm -74.76 128.62 36.0 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.143 -0.48 . . . . 61.210000000000001 110.904 179.957 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.481 HD22 ' HG2' ' A' ' 120' ' ' GLU . 10.4 mt -133.17 126.69 32.2 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.235 -0.438 . . . . 75.209999999999994 110.904 179.954 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . 0.624 ' O ' HG23 ' A' ' 121' ' ' VAL . 68.6 p -79.3 -175.06 4.48 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.212 -0.449 . . . . 55.009999999999998 111.109 179.952 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -59.84 -40.26 87.92 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.18 -0.464 . . . . 71.510000000000005 110.865 179.935 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -75.71 -33.39 60.32 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.253 -0.431 . . . . 73.420000000000002 110.86 -179.912 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . 0.481 ' HG2' HD22 ' A' ' 116' ' ' LEU . 46.8 tt0 -71.98 -38.17 69.74 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.163 -0.471 . . . . 63.219999999999999 110.894 -179.931 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.624 HG23 ' O ' ' A' ' 117' ' ' THR . 92.8 t -74.31 -30.55 26.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.181 -0.463 . . . . 75.239999999999995 111.109 179.973 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -78.54 -28.29 46.07 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.2 -0.455 . . . . 73.530000000000001 110.839 179.961 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 23.0 tp10 -55.52 -49.99 71.16 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.224 -0.444 . . . . 72.400000000000006 110.904 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . 0.525 ' CE ' HD21 ' A' ' 105' ' ' LEU . 13.6 ptm -66.42 -44.12 83.83 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.156 -0.474 . . . . 50.420000000000002 110.922 179.953 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 29.3 mm -53.87 -35.38 27.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.175 -0.466 . . . . 75.340000000000003 111.138 179.945 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 14.1 ttt85 -67.18 -31.7 72.28 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.187 -0.46 . . . . 75.209999999999994 110.867 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 13.1 tp10 -69.14 -45.16 70.8 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.18 -0.464 . . . . 72.329999999999998 110.923 -179.975 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.602 ' HB3' HG22 ' A' ' 136' ' ' VAL . . . -77.12 -33.18 56.88 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.154 -0.476 . . . . 63.299999999999997 111.091 179.918 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 47.6 t0 -68.9 85.99 0.34 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.258 -0.428 . . . . 72.230000000000004 110.836 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 57.0 mt -79.69 -45.55 23.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.218 -0.446 . . . . 72.040000000000006 111.135 179.977 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 24.5 p30 -72.87 -8.63 56.46 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.175 -0.466 . . . . 61.340000000000003 110.854 179.849 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 62.72 41.91 99.77 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.793 -0.718 . . . . 52.509999999999998 112.463 -179.952 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 13.3 p-10 -87.6 -15.84 36.21 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.843 0.354 . . . . 75.230000000000004 110.851 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 102.41 4.23 49.99 Favored Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.687 -0.768 . . . . 62.32 112.482 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -149.19 172.18 15.26 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.861 0.362 . . . . 71.420000000000002 110.909 -179.873 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 136' ' ' VAL . . . . . 0.602 HG22 ' HB3' ' A' ' 128' ' ' ALA . 99.6 t -110.83 113.75 45.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.185 -0.461 . . . . 63.539999999999999 111.128 179.976 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 14.0 p30 -91.02 167.87 12.07 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.132 -0.486 . . . . 72.420000000000002 110.885 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . 0.594 ' O ' HG23 ' A' ' 142' ' ' VAL . 88.7 t80 -52.08 -47.17 65.32 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.171 -0.468 . . . . 64.549999999999997 110.92 -179.909 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 26.1 tp10 -52.53 -51.78 57.95 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.104 -0.498 . . . . 64.200000000000003 110.844 -179.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 51.7 mt-10 -66.16 -39.88 90.11 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.179 -0.464 . . . . 54.109999999999999 110.899 -179.919 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 75.7 t80 -59.45 -49.16 78.86 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.181 -0.463 . . . . 74.120000000000005 110.879 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . 0.594 HG23 ' O ' ' A' ' 138' ' ' TYR . 91.8 t -56.58 -40.08 66.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.164 -0.471 . . . . 75.430000000000007 111.162 179.94 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 6.9 tp-100 -70.01 -28.34 65.42 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.179 -0.464 . . . . 75.25 110.895 179.998 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 9.5 tpt -74.6 -54.03 8.24 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.229 -0.441 . . . . 61.5 110.89 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 145' ' ' MET . . . . . 0.484 ' HE2' ' HA ' ' M' ' 20' ' ' ARG . 7.7 ttm -66.88 -27.17 67.29 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.218 -0.446 . . . . 71.019999999999996 110.875 179.942 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 2.3 m -108.75 21.23 17.52 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.233 -0.439 . . . . 54.229999999999997 111.139 -179.888 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -60.24 -172.0 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.241 -0.436 . . . . 53.009999999999998 111.073 179.883 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.303 0 CA-C-N 116.196 -0.456 . . . . 72.420000000000002 110.918 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' M' M ' 8' ' ' LEU . . . . . . . . . . . . . 17.0 mt . . . . . 0 C--O 1.231 0.108 0 CA-C-O 120.796 0.331 . . . . 64.430000000000007 110.909 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' M' M ' 9' ' ' SER . . . . . . . . . . . . . 5.4 t -174.4 81.73 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.18 -0.464 . . . . 53.439999999999998 110.89 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' M' M ' 10' ' ' GLY . . . . . . . . . . . . . . . -175.54 -148.6 6.91 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.769 -0.729 . . . . 25.25 112.519 -179.944 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' M' M ' 11' ' ' GLY . . . . . . . . . . . . . . . -138.5 22.91 3.0 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.761 -0.733 . . . . 64.239999999999995 112.502 -179.935 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' M' M ' 12' ' ' GLU . . . . . . . . . . . . . 28.2 mm-40 -100.7 167.6 10.22 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.873 0.368 . . . . 72.310000000000002 110.866 -179.852 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' M' M ' 13' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -87.74 76.23 8.84 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.14 -0.482 . . . . 73.129999999999995 110.936 -179.955 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' M' M ' 14' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -102.47 24.32 10.56 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.186 -0.461 . . . . 74.409999999999997 110.87 179.873 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' M' M ' 15' ' ' LYS . . . . . . . . . . . . . 24.1 mttp -79.1 -49.9 11.89 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.204 -0.453 . . . . 74.129999999999995 110.852 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' M' M ' 16' ' ' TRP . . . . . 0.707 ' CE3' HD12 ' M' ' 19' ' ' ILE . 46.2 m95 -52.77 -40.55 63.26 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.217 -0.447 . . . . 74.109999999999999 110.904 179.972 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' M' M ' 17' ' ' GLU . . . . . . . . . . . . . 28.5 tt0 -55.43 -26.28 41.0 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.234 -0.439 . . . . 55.509999999999998 110.87 -179.948 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' M' M ' 18' ' ' LYS . . . . . . . . . . . . . 16.2 ttpp -77.65 -28.02 51.16 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.145 -0.48 . . . . 73.319999999999993 110.841 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' M' M ' 19' ' ' ILE . . . . . 0.767 HD11 ' HE2' ' A' ' 109' ' ' MET . 60.2 mt -78.3 -29.38 15.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.22 -0.446 . . . . 63.32 111.164 179.894 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' M' M ' 20' ' ' ARG . . . . . 0.484 ' HA ' ' HE2' ' A' ' 145' ' ' MET . 0.2 OUTLIER -54.02 -28.71 40.01 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.157 -0.474 . . . . 63.130000000000003 110.906 179.906 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' M' M ' 21' ' ' LEU . . . . . . . . . . . . . 5.0 mt 57.59 -179.99 0.06 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.186 -0.461 . . . . 71.310000000000002 110.903 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' M' M ' 22' ' ' ARG . . . . . 0.401 ' N ' ' CD ' ' M' ' 23' ' ' PRO . 25.0 ptt180 -173.48 57.02 0.21 Allowed Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.533 0.682 . . . . 74.430000000000007 110.873 179.96 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' M' M ' 23' ' ' PRO . . . . . 0.401 ' CD ' ' N ' ' M' ' 22' ' ' ARG . 53.8 Cg_endo -69.7 174.83 8.88 Favored 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.671 2.248 . . . . 70.430000000000007 112.352 179.993 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' M' M ' 24' ' ' GLY . . . . . . . . . . . . . . . -111.89 41.55 2.2 Favored Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.692 -0.766 . . . . 52.130000000000003 112.438 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' M' M ' 25' ' ' GLY . . . . . . . . . . . . . . . -69.54 -144.62 0.19 Allowed Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.743 -0.741 . . . . 42.399999999999999 112.504 -179.937 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' M' M ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -156.15 -175.99 5.72 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.829 0.347 . . . . 72.400000000000006 110.885 -179.94 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' M' M ' 27' ' ' LYS . . . . . 0.646 ' HG2' HG23 ' A' ' 79' ' ' THR . 10.1 mttp -51.76 149.98 4.32 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.203 -0.453 . . . . 72.400000000000006 110.893 179.851 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' M' M ' 28' ' ' GLN . . . . . . . . . . . . . 27.8 mm100 -149.59 102.25 3.15 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.248 -0.433 . . . . 75.530000000000001 110.959 179.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' M' M ' 29' ' ' TYR . . . . . 0.56 ' CE1' HG13 ' A' ' 55' ' ' VAL . 0.2 OUTLIER -113.47 -25.54 8.73 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.237 -0.438 . . . . 64.099999999999994 110.953 -179.832 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' M' M ' 30' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 62.88 20.55 12.28 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.083 -0.508 . . . . 74.219999999999999 110.905 179.916 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' M' M ' 31' ' ' LEU . . . . . 0.488 HD23 HG11 ' A' ' 55' ' ' VAL . 25.9 tp -141.72 -55.44 0.46 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.258 -0.428 . . . . 72.439999999999998 110.897 179.938 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' M' M ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.68 -45.38 48.71 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.183 -0.462 . . . . 55.119999999999997 110.909 179.851 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' M' M ' 33' ' ' HIS . . . . . . . . . . . . . 19.0 t-80 -50.36 -36.91 34.42 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.166 -0.47 . . . . 62.130000000000003 110.864 179.897 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' M' M ' 34' ' ' ILE . . . . . . . . . . . . . 49.7 mm -49.74 -40.83 16.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.191 -0.459 . . . . 51.140000000000001 111.171 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' M' M ' 35' ' ' VAL . . . . . 0.471 HG11 ' HE2' ' A' ' 72' ' ' MET . 65.9 t -49.26 -40.63 13.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.15 -0.477 . . . . 65.030000000000001 111.176 179.772 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' M' M ' 36' ' ' TRP . . . . . . . . . . . . . 28.8 m0 -59.31 -38.88 81.35 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.14 -0.482 . . . . 65.420000000000002 110.965 179.962 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' M' M ' 37' ' ' ALA . . . . . 0.941 ' HB3' HD13 ' A' ' 39' ' ' LEU . . . -63.9 -18.61 64.37 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.167 -0.47 . . . . 73.0 111.108 179.876 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' M' M ' 38' ' ' SER . . . . . . . . . . . . . 2.5 m -70.61 -17.97 62.89 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.234 -0.439 . . . . 53.420000000000002 110.86 -179.82 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' M' M ' 39' ' ' ARG . . . . . . . . . . . . . 16.2 mmm180 -60.13 -26.8 66.54 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.176 -0.466 . . . . 75.129999999999995 110.878 -179.932 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' M' M ' 40' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -74.63 -47.76 30.28 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.205 -0.452 . . . . 64.150000000000006 110.908 -179.946 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' M' M ' 41' ' ' LEU . . . . . 0.619 HD11 ' OG ' ' A' ' 38' ' ' SER . 15.3 mt -53.31 171.37 0.08 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.17 -0.468 . . . . 62.43 110.92 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' M' M ' 42' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -133.5 27.69 4.04 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.21 -0.45 . . . . 72.439999999999998 110.908 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' M' M ' 43' ' ' ARG . . . . . . . . . . . . . 11.4 ttt85 . . . . . 0 C--N 1.329 -0.317 0 CA-C-N 116.093 -0.503 . . . . 72.420000000000002 110.886 -179.914 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 241' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 262' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 301' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 322' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.103 0 CA-C-O 120.772 0.32 . . . . 44.409999999999997 111.079 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 19.7 m-20 -129.05 51.53 2.04 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.242 -0.436 . . . . 52.43 110.877 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 11.4 tp60 -135.58 115.71 13.33 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.188 -0.46 . . . . 70.140000000000001 110.902 -179.888 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.688 HD22 ' HG2' ' A' ' 8' ' ' GLN . 10.5 mt -100.25 164.22 12.05 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.17 -0.468 . . . . 52.399999999999999 110.895 -179.96 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 78.5 p -121.67 171.95 8.48 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.198 -0.455 . . . . 43.32 111.144 179.937 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 12.0 tp10 -53.34 -28.66 29.95 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.249 -0.432 . . . . 72.140000000000001 110.886 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 8.0 tm-20 -66.79 -39.13 87.66 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.127 -0.488 . . . . 63.109999999999999 110.92 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . 0.688 ' HG2' HD22 ' A' ' 4' ' ' LEU . 7.5 tp60 -77.75 -41.95 35.8 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.088 -0.506 . . . . 61.439999999999998 110.893 -179.936 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 41.4 mt -68.58 -37.09 77.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.209 -0.451 . . . . 74.140000000000001 111.12 179.975 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -52.0 -33.16 37.03 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.15 -0.477 . . . . 75.319999999999993 111.139 179.815 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 16.2 mm-40 -74.9 -51.87 12.73 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.203 -0.453 . . . . 65.439999999999998 110.878 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.562 ' CB ' HD13 ' A' ' 69' ' ' LEU . 64.5 m-85 -58.18 -46.03 86.47 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.191 -0.459 . . . . 73.519999999999996 110.888 -179.925 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 19.5 ttmm -54.18 -30.45 49.58 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.159 -0.473 . . . . 75.129999999999995 110.886 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -70.84 -30.69 67.18 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.223 -0.444 . . . . 65.209999999999994 110.87 179.946 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -67.02 -48.16 69.22 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.16 -0.473 . . . . 65.200000000000003 111.083 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 79.2 t80 -56.09 -54.28 46.97 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.2 -0.454 . . . . 63.210000000000001 110.891 -179.932 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 20.6 t -58.99 -26.49 64.54 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.174 -0.466 . . . . 53.340000000000003 110.88 -179.8 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 1.2 tt -68.75 -37.33 79.31 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.117 -0.492 . . . . 73.140000000000001 110.909 -179.999 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.625 ' CD1' HG11 ' A' ' 35' ' ' VAL . 22.3 m-85 -81.33 -39.09 25.65 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.19 -0.459 . . . . 75.430000000000007 110.88 179.943 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 26.5 t0 -62.97 98.56 0.13 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.164 -0.471 . . . . 73.549999999999997 110.906 179.931 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.14 -56.05 6.24 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.223 -0.444 . . . . 75.129999999999995 110.919 179.978 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 2.3 p-10 -70.86 -10.45 59.62 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.212 -0.449 . . . . 70.230000000000004 110.859 179.901 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 50.86 66.43 2.47 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.708 -0.758 . . . . 74.019999999999996 112.496 -179.93 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 35.3 p-10 -114.47 -15.71 12.02 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.828 0.347 . . . . 51.420000000000002 110.848 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 100.53 10.28 44.62 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.755 -0.736 . . . . 75.230000000000004 112.457 -179.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 51.0 p -151.29 130.7 12.91 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.771 0.319 . . . . 61.399999999999999 111.135 -179.865 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.48 HD12 ' HB ' ' A' ' 63' ' ' ILE . 22.5 mt -91.08 121.78 41.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.218 -0.446 . . . . 74.010000000000005 111.071 179.952 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.411 ' HA ' HG22 ' A' ' 62' ' ' THR . 30.0 p -107.77 172.82 6.62 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.153 -0.476 . . . . 54.200000000000003 111.128 179.932 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.4 HG22 HD12 ' A' ' 52' ' ' ILE . 71.4 p -61.41 -27.55 68.61 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.201 -0.454 . . . . 71.299999999999997 111.164 -179.991 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 19.5 mmmt -75.7 -35.19 60.36 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.223 -0.444 . . . . 64.349999999999994 110.93 179.909 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 -76.06 -32.66 59.4 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.19 -0.459 . . . . 74.319999999999993 110.898 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.651 HD12 ' CD2' ' A' ' 48' ' ' LEU . 1.2 tm? -67.15 -39.79 86.6 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.123 -0.49 . . . . 65.200000000000003 110.93 -179.965 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -67.92 -35.51 84.68 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.71 -0.757 . . . . 72.450000000000003 112.528 179.849 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 74.6 m -62.81 -55.47 26.11 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.808 0.337 . . . . 54.409999999999997 111.158 -179.876 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.625 HG11 ' CD1' ' A' ' 19' ' ' PHE . 92.4 t -65.28 -53.32 41.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.248 -0.433 . . . . 75.349999999999994 111.109 179.901 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -51.9 -31.5 28.66 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.179 -0.464 . . . . 72.450000000000003 110.884 179.947 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 48.6 ttt180 -65.95 -47.09 75.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.221 -0.445 . . . . 71.200000000000003 110.897 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . 0.629 ' OG ' HD11 ' M' ' 41' ' ' LEU . 1.3 p -63.66 -33.67 76.15 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.159 -0.473 . . . . 65.040000000000006 110.888 -179.81 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.948 HD13 ' HB3' ' M' ' 37' ' ' ALA . 57.7 mt -68.09 -22.11 64.93 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.1 -0.5 . . . . 73.019999999999996 110.91 -179.979 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 101.43 31.37 5.56 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.729 -0.748 . . . . 74.340000000000003 112.505 179.915 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 13.9 mt-30 -128.29 118.62 23.57 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.793 0.33 . . . . 64.010000000000005 110.911 -179.896 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 1.2 t30 -109.86 76.92 1.0 Allowed Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.65 0.738 . . . . 61.149999999999999 110.86 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.521 ' HG2' HD21 ' A' ' 48' ' ' LEU . 53.3 Cg_endo -69.85 168.08 22.71 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.695 2.263 . . . . 65.439999999999998 112.297 179.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 30.9 p -90.78 161.69 15.18 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.234 -0.439 . . . . 71.319999999999993 111.081 -179.91 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 25.2 tt0 -51.95 -43.7 63.62 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.157 -0.474 . . . . 72.329999999999998 110.883 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.14 -31.49 64.3 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.142 -0.481 . . . . 61.25 111.063 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 53.7 tt0 -65.96 -48.25 71.93 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.238 -0.437 . . . . 60.039999999999999 110.917 -179.938 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.651 ' CD2' HD12 ' A' ' 32' ' ' LEU . 46.4 mt -55.34 -35.35 65.09 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.152 -0.476 . . . . 71.299999999999997 110.932 -179.984 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 43.8 tp60 -70.92 -28.96 64.9 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.184 -0.462 . . . . 72.129999999999995 110.873 179.945 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 29.3 t0 -68.73 -46.61 68.47 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.216 -0.447 . . . . 65.150000000000006 110.869 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . 0.601 ' SD ' HD11 ' M' ' 34' ' ' ILE . 10.7 mtp -60.18 -53.0 62.9 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.184 -0.462 . . . . 72.310000000000002 110.877 179.992 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.667 HG23 HD11 ' A' ' 63' ' ' ILE . 73.3 mt -60.46 -41.25 86.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.226 -0.443 . . . . 51.219999999999999 111.159 179.962 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 70.7 m-20 -67.89 -32.73 73.42 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.155 -0.475 . . . . 74.329999999999998 110.894 179.934 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 18.4 mm-40 -61.01 -23.28 65.29 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.182 -0.463 . . . . 54.420000000000002 110.887 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.49 ' CG2' HD12 ' A' ' 63' ' ' ILE . 3.8 m -112.52 -14.89 10.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.162 -0.472 . . . . 40.009999999999998 111.109 179.96 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 33.0 t0 -66.79 97.07 0.44 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.172 -0.467 . . . . 71.510000000000005 110.85 179.936 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.46 -32.71 18.12 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.159 -0.473 . . . . 72.099999999999994 111.074 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -91.69 -0.43 57.56 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.234 -0.439 . . . . 72.25 110.851 179.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 51.46 62.21 5.68 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.699 -0.762 . . . . 41.149999999999999 112.509 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 50.7 p-10 -114.58 -15.75 11.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.864 0.364 . . . . 60.240000000000002 110.877 -179.873 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 89.11 15.83 58.54 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.751 -0.738 . . . . 63.100000000000001 112.49 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . 0.411 HG22 ' HA ' ' A' ' 28' ' ' THR . 30.7 p -152.17 161.54 42.47 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.758 0.313 . . . . 74.540000000000006 111.143 -179.865 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.667 HD11 HG23 ' A' ' 52' ' ' ILE . 8.6 mm -99.26 114.8 38.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.194 -0.457 . . . . 72.519999999999996 111.133 179.921 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -81.79 -173.01 4.2 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.153 -0.476 . . . . 63.329999999999998 110.88 179.846 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.535 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 2.5 t80 -66.55 -58.3 10.38 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.669 0.747 . . . . 74.409999999999997 110.857 -179.911 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . 0.535 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 53.1 Cg_endo -69.78 -29.41 23.8 Favored 'Trans proline' 0 C--N 1.342 0.202 0 C-N-CA 122.677 2.251 . . . . 73.450000000000003 112.332 -179.947 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -61.48 -40.26 93.91 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.217 -0.447 . . . . 72.040000000000006 110.896 -179.976 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 14.7 t80 -74.52 -35.56 63.16 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.149 -0.478 . . . . 53.200000000000003 110.886 -179.955 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.562 HD13 ' CB ' ' A' ' 12' ' ' PHE . 19.0 tp -69.98 -54.16 14.49 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.121 -0.49 . . . . 72.209999999999994 110.921 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 14.8 t -51.93 -29.77 21.68 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.146 -0.479 . . . . 75.310000000000002 111.109 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 3.6 tmm? -61.86 -43.4 98.92 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.247 -0.433 . . . . 74.150000000000006 110.844 179.937 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . 0.586 ' HE3' HG11 ' M' ' 35' ' ' VAL . 3.8 mmt -79.85 -29.4 40.06 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.249 -0.432 . . . . 71.310000000000002 110.846 179.999 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -74.84 -28.47 60.7 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.233 -0.44 . . . . 75.140000000000001 111.146 179.909 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.11 -19.32 65.81 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.178 -0.465 . . . . 63.219999999999999 110.908 -179.952 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 19.7 pttp -51.44 -30.92 21.18 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.178 -0.465 . . . . 74.010000000000005 110.887 179.962 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -63.31 -43.46 97.77 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.28 -0.418 . . . . 74.230000000000004 110.904 179.864 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 7.7 ttpt -64.44 172.21 2.73 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.201 -0.454 . . . . 74.450000000000003 110.884 179.961 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . 0.515 ' O ' HG23 ' A' ' 79' ' ' THR . 78.6 m-20 -83.62 136.76 34.1 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.193 -0.458 . . . . 73.120000000000005 110.874 179.891 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . 0.515 HG23 ' O ' ' A' ' 78' ' ' ASP . 0.7 OUTLIER -162.17 84.9 0.58 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.2 -0.455 . . . . 72.099999999999994 111.124 -179.857 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -115.36 -29.35 6.58 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.22 -0.445 . . . . 65.129999999999995 110.864 179.902 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 1.5 t -64.77 -52.63 55.91 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.223 -0.444 . . . . 73.0 110.866 -179.771 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.636 ' HA ' HD12 ' A' ' 85' ' ' ILE . 61.7 mm-40 -62.87 -25.99 68.56 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.128 -0.487 . . . . 75.409999999999997 110.89 -179.974 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 6.5 tm-20 -67.56 -37.5 82.74 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.196 -0.456 . . . . 71.219999999999999 110.892 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.65 ' OE2' HD12 ' M' ' 21' ' ' LEU . 53.6 tp10 -77.67 -30.35 51.96 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.091 -0.504 . . . . 62.310000000000002 110.921 -179.927 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.636 HD12 ' HA ' ' A' ' 82' ' ' GLU . 47.7 mt -69.63 -51.05 45.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.127 -0.488 . . . . 74.5 111.147 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 2.7 ttt180 -61.13 -32.42 72.12 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.167 -0.469 . . . . 71.140000000000001 110.865 179.942 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.715 ' O ' HG23 ' A' ' 91' ' ' VAL . 35.2 mt-10 -76.68 -57.18 4.0 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.224 -0.444 . . . . 62.409999999999997 110.9 -179.924 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . 0.437 ' HB1' ' CE2' ' A' ' 92' ' ' PHE . . . -53.49 -51.03 64.08 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.177 -0.465 . . . . 55.109999999999999 111.081 179.924 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -54.2 -41.79 69.0 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.191 -0.458 . . . . 54.109999999999999 110.878 -179.932 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 73.1 ttt180 -70.41 -27.32 64.19 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.161 -0.472 . . . . 62.5 110.9 -179.942 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . 0.715 HG23 ' O ' ' A' ' 87' ' ' GLU . 93.7 t -75.61 -28.26 19.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.178 -0.464 . . . . 62.299999999999997 111.141 -179.996 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.467 ' CE1' HG11 ' A' ' 108' ' ' VAL . 8.8 m-85 -93.08 -35.64 13.11 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.144 -0.48 . . . . 75.219999999999999 110.898 -179.974 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 35.1 t0 -64.67 94.16 0.12 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.125 -0.489 . . . . 61.520000000000003 110.857 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 10.1 tppt? -78.64 -51.52 9.76 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.193 -0.458 . . . . 74.349999999999994 110.915 179.961 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 17.8 p30 -72.7 -9.14 58.28 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.218 -0.446 . . . . 74.299999999999997 110.834 179.919 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 59.76 28.32 65.45 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.713 -0.756 . . . . 62.310000000000002 112.528 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 43.8 p-10 -81.85 -16.18 51.64 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.887 0.375 . . . . 70.109999999999999 110.893 -179.87 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 91.03 18.64 46.05 Favored Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.717 -0.754 . . . . 73.540000000000006 112.5 179.963 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 12.5 m-85 -136.6 148.18 47.36 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.907 0.384 . . . . 71.230000000000004 110.933 -179.812 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 78.8 mt -113.78 121.33 65.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.139 -0.482 . . . . 64.219999999999999 111.114 179.921 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 17.8 p -116.2 175.25 5.63 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.145 -0.479 . . . . 74.510000000000005 110.859 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . 0.405 ' HB1' HG12 ' A' ' 121' ' ' VAL . . . -66.33 -33.32 75.48 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.129 -0.487 . . . . 74.340000000000003 111.079 179.933 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -61.59 -49.93 74.64 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.251 -0.431 . . . . 73.420000000000002 111.076 179.987 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 23.7 mt-10 -76.91 -49.18 16.21 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.207 -0.452 . . . . 74.430000000000007 110.925 -179.962 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.535 HD21 ' CE ' ' A' ' 124' ' ' MET . 18.9 tp -53.3 -34.49 57.55 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.114 -0.494 . . . . 54.409999999999997 110.931 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 57.4 ttp180 -59.8 -48.05 83.23 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.2 -0.455 . . . . 75.25 110.843 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 70.9 t60 -54.38 -34.39 61.12 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.203 -0.453 . . . . 61.420000000000002 110.831 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.467 HG11 ' CE1' ' A' ' 92' ' ' PHE . 42.3 t -65.5 -48.9 81.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.243 -0.435 . . . . 72.430000000000007 111.139 -179.994 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 7.6 mmt -59.48 -45.06 92.75 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.163 -0.471 . . . . 54.140000000000001 110.866 179.922 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -57.56 -39.11 75.96 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.183 -0.462 . . . . 72.140000000000001 111.183 -179.942 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 10.6 t-20 -74.59 -26.55 59.99 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.168 -0.469 . . . . 72.219999999999999 110.9 179.966 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 12.3 mt -70.77 -25.97 63.14 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.238 -0.437 . . . . 63.420000000000002 110.903 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 101.01 33.02 5.11 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.724 -0.75 . . . . 74.140000000000001 112.452 179.862 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -124.05 113.43 18.38 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.948 0.404 . . . . 70.530000000000001 110.865 -179.863 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . 0.672 ' O ' HD23 ' A' ' 116' ' ' LEU . 9.1 pttm -70.32 118.68 13.44 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.131 -0.486 . . . . 74.420000000000002 110.913 179.967 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.672 HD23 ' O ' ' A' ' 115' ' ' LYS . 24.5 mt -137.41 163.3 31.39 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.2 -0.455 . . . . 71.230000000000004 110.89 179.97 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . 0.453 ' O ' HG23 ' A' ' 121' ' ' VAL . 65.9 p -113.01 174.45 5.89 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.22 -0.445 . . . . 74.109999999999999 111.132 179.925 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -53.37 -48.11 68.88 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.223 -0.444 . . . . 64.109999999999999 110.875 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 49.9 tt0 -62.47 -38.57 90.35 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.23 -0.441 . . . . 72.120000000000005 110.886 -179.92 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . 0.655 ' HG2' HD22 ' A' ' 116' ' ' LEU . 7.4 tp10 -61.55 -46.77 88.52 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.143 -0.48 . . . . 72.519999999999996 110.897 -179.95 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.453 HG23 ' O ' ' A' ' 117' ' ' THR . 62.1 t -57.07 -32.22 39.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.18 -0.464 . . . . 71.319999999999993 111.127 179.974 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 3.1 t70 -78.51 -28.49 46.29 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.192 -0.458 . . . . 61.329999999999998 110.88 179.919 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 34.5 tp10 -55.6 -50.0 71.28 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.203 -0.453 . . . . 73.319999999999993 110.88 -179.928 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . 0.535 ' CE ' HD21 ' A' ' 105' ' ' LEU . 13.4 ptm -66.61 -44.36 82.29 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.16 -0.473 . . . . 53.350000000000001 110.878 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 28.9 mm -53.88 -35.47 27.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.189 -0.46 . . . . 65.120000000000005 111.099 179.959 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 18.3 ttt-85 -66.88 -31.58 72.28 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.197 -0.456 . . . . 73.439999999999998 110.868 179.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 6.9 tm-20 -70.36 -47.26 61.79 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.164 -0.471 . . . . 75.150000000000006 110.83 -179.896 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.47 ' HB3' HG22 ' A' ' 136' ' ' VAL . . . -74.23 -33.8 63.47 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.184 -0.462 . . . . 65.319999999999993 111.068 179.957 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 50.1 t0 -68.54 86.74 0.31 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.257 -0.429 . . . . 62.329999999999998 110.867 -179.999 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 57.7 mt -79.75 -45.61 23.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.182 -0.463 . . . . 73.140000000000001 111.116 -179.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 22.9 p30 -72.73 -8.69 56.62 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.201 -0.454 . . . . 73.329999999999998 110.851 179.864 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 62.31 41.57 99.74 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.769 -0.729 . . . . 62.039999999999999 112.517 -179.925 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 34.6 p-10 -86.85 -15.91 37.71 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.851 0.358 . . . . 73.239999999999995 110.848 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 101.93 3.72 51.78 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.76 -0.733 . . . . 62.43 112.47 -179.94 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 3.5 tt0 -149.23 172.22 15.21 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.83 0.348 . . . . 53.329999999999998 110.895 -179.892 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 136' ' ' VAL . . . . . 0.47 HG22 ' HB3' ' A' ' 128' ' ' ALA . 95.0 t -111.66 108.56 25.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.214 -0.448 . . . . 73.340000000000003 111.134 180.0 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 17.5 p30 -86.24 175.62 8.38 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.163 -0.471 . . . . 62.530000000000001 110.877 -179.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . 0.604 ' O ' HG23 ' A' ' 142' ' ' VAL . 39.6 t80 -60.94 -46.52 90.38 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.193 -0.458 . . . . 54.32 110.968 -179.963 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 79.4 tt0 -52.62 -36.45 56.48 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.054 -0.521 . . . . 74.25 110.878 -179.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -78.41 -40.62 35.39 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.145 -0.479 . . . . 75.329999999999998 110.872 -179.911 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . 0.577 ' HD1' HG23 ' A' ' 85' ' ' ILE . 26.7 t80 -62.31 -46.92 86.56 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.177 -0.465 . . . . 74.219999999999999 110.88 -179.891 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . 0.608 HG13 HD13 ' A' ' 85' ' ' ILE . 83.1 t -51.61 -46.93 38.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.186 -0.461 . . . . 73.319999999999993 111.164 179.917 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . 0.523 ' O ' ' HB2' ' A' ' 147' ' ' ALA . 3.8 tt0 -71.9 -24.96 61.74 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.175 -0.466 . . . . 70.319999999999993 110.939 179.998 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 7.0 tpt -74.04 -42.36 60.38 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.192 -0.458 . . . . 71.129999999999995 110.883 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -71.77 -27.7 63.14 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.238 -0.437 . . . . 72.230000000000004 110.901 179.926 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 1.8 m -110.41 21.29 16.83 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.239 -0.437 . . . . 72.219999999999999 111.098 -179.885 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . 0.619 ' HB3' ' NH2' ' M' ' 20' ' ' ARG . . . -75.48 -175.83 2.96 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.232 -0.44 . . . . 65.150000000000006 111.095 179.858 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 8.9 tptm . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 116.213 -0.449 . . . . 65.010000000000005 110.907 179.924 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' M' M ' 8' ' ' LEU . . . . . . . . . . . . . 5.2 mp . . . . . 0 C--O 1.231 0.1 0 CA-C-O 120.828 0.347 . . . . 71.25 110.93 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' M' M ' 9' ' ' SER . . . . . . . . . . . . . 6.7 m -63.76 -177.2 0.22 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.242 -0.435 . . . . 74.019999999999996 110.853 -179.946 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' M' M ' 10' ' ' GLY . . . . . . . . . . . . . . . 173.8 -160.62 30.75 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.737 -0.744 . . . . 70.120000000000005 112.468 -179.975 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' M' M ' 11' ' ' GLY . . . . . . . . . . . . . . . -91.46 -82.62 1.44 Allowed Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.731 -0.747 . . . . 31.210000000000001 112.517 -179.926 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' M' M ' 12' ' ' GLU . . . . . . . . . . . . . 10.1 mt-10 -60.9 -172.94 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.834 0.35 . . . . 74.540000000000006 110.87 -179.859 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' M' M ' 13' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -87.99 75.63 8.74 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.179 -0.464 . . . . 73.099999999999994 110.894 -179.967 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' M' M ' 14' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -101.76 24.12 10.34 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.223 -0.444 . . . . 73.530000000000001 110.863 179.858 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' M' M ' 15' ' ' LYS . . . . . . . . . . . . . 7.3 mtmp? -79.09 -39.92 32.53 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.178 -0.464 . . . . 70.140000000000001 110.917 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' M' M ' 16' ' ' TRP . . . . . 0.721 ' CE3' HD12 ' M' ' 19' ' ' ILE . 18.0 m95 -54.6 -41.14 69.57 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.149 -0.478 . . . . 73.299999999999997 110.953 179.917 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' M' M ' 17' ' ' GLU . . . . . . . . . . . . . 15.8 tt0 -57.87 -26.57 62.28 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.215 -0.448 . . . . 71.420000000000002 110.862 -179.974 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' M' M ' 18' ' ' LYS . . . . . 0.508 ' O ' HD23 ' M' ' 21' ' ' LEU . 19.8 tttp -73.5 -25.75 60.58 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.165 -0.471 . . . . 54.009999999999998 110.916 179.965 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' M' M ' 19' ' ' ILE . . . . . 0.721 HD12 ' CE3' ' M' ' 16' ' ' TRP . 31.5 mt -82.63 -20.96 9.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.194 -0.457 . . . . 73.219999999999999 111.103 179.882 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' M' M ' 20' ' ' ARG . . . . . 0.619 ' NH2' ' HB3' ' A' ' 147' ' ' ALA . 36.6 ttm180 -72.62 -27.12 61.96 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.199 -0.455 . . . . 71.439999999999998 110.921 179.918 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' M' M ' 21' ' ' LEU . . . . . 0.65 HD12 ' OE2' ' A' ' 84' ' ' GLU . 8.3 mt 52.31 -169.94 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.19 -0.459 . . . . 74.030000000000001 110.957 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' M' M ' 22' ' ' ARG . . . . . . . . . . . . . 30.7 ptt85 -160.53 57.01 0.85 Allowed Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.585 0.707 . . . . 71.319999999999993 110.904 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' M' M ' 23' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.73 -48.29 0.76 Allowed 'Trans proline' 0 N--CA 1.465 -0.168 0 C-N-CA 122.683 2.255 . . . . 70.430000000000007 112.38 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' M' M ' 24' ' ' GLY . . . . . . . . . . . . . . . 133.39 -48.69 0.94 Allowed Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.745 -0.74 . . . . 72.420000000000002 112.514 179.987 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' M' M ' 25' ' ' GLY . . . . . . . . . . . . . . . 62.03 164.44 0.35 Allowed Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.756 -0.735 . . . . 35.130000000000003 112.477 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' M' M ' 26' ' ' LYS . . . . . . . . . . . . . 42.3 mmtt -151.03 -74.18 0.15 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.889 0.376 . . . . 74.150000000000006 110.954 179.975 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' M' M ' 27' ' ' LYS . . . . . . . . . . . . . 51.9 mtmt -150.81 134.97 16.86 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.206 -0.452 . . . . 64.540000000000006 110.902 179.813 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' M' M ' 28' ' ' GLN . . . . . . . . . . . . . 4.1 mt-30 -162.28 177.58 9.48 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.207 -0.451 . . . . 74.219999999999999 110.882 179.96 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' M' M ' 29' ' ' TYR . . . . . 0.407 ' CE1' HG13 ' A' ' 55' ' ' VAL . 0.4 OUTLIER -176.29 140.75 0.4 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.163 -0.471 . . . . 63.32 110.956 -179.82 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' M' M ' 30' ' ' LYS . . . . . . . . . . . . . 11.4 tttm -88.18 50.0 1.9 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.126 -0.488 . . . . 62.43 110.896 179.946 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' M' M ' 31' ' ' LEU . . . . . 0.569 HD12 HD12 ' M' ' 34' ' ' ILE . 10.0 tp 179.72 -47.87 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.265 -0.425 . . . . 60.119999999999997 110.925 179.917 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' M' M ' 32' ' ' LYS . . . . . . . . . . . . . 1.3 ttmm -48.26 -45.8 34.9 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.179 -0.464 . . . . 74.340000000000003 110.879 179.816 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' M' M ' 33' ' ' HIS . . . . . . . . . . . . . 35.1 t60 -49.99 -39.82 42.31 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.211 -0.449 . . . . 73.430000000000007 110.877 179.928 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' M' M ' 34' ' ' ILE . . . . . 0.601 HD11 ' SD ' ' A' ' 51' ' ' MET . 58.9 mt -50.08 -40.21 16.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.197 -0.456 . . . . 71.109999999999999 111.091 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' M' M ' 35' ' ' VAL . . . . . 0.586 HG11 ' HE3' ' A' ' 72' ' ' MET . 62.5 t -48.36 -41.29 10.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.227 -0.442 . . . . 74.420000000000002 111.101 179.864 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' M' M ' 36' ' ' TRP . . . . . . . . . . . . . 22.0 m0 -58.43 -40.47 82.6 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.217 -0.447 . . . . 73.120000000000005 110.914 179.988 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' M' M ' 37' ' ' ALA . . . . . 0.948 ' HB3' HD13 ' A' ' 39' ' ' LEU . . . -64.09 -18.85 64.79 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.201 -0.454 . . . . 45.549999999999997 111.106 179.888 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' M' M ' 38' ' ' SER . . . . . . . . . . . . . 1.1 m -69.31 -17.94 63.77 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.223 -0.444 . . . . 72.200000000000003 110.84 -179.764 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' M' M ' 39' ' ' ARG . . . . . . . . . . . . . 45.0 mtp180 -71.51 -21.76 61.88 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.163 -0.471 . . . . 41.420000000000002 110.869 -179.93 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' M' M ' 40' ' ' GLU . . . . . . . . . . . . . 22.2 mm-40 -73.94 -48.0 33.71 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.206 -0.452 . . . . 54.420000000000002 110.924 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' M' M ' 41' ' ' LEU . . . . . 0.629 HD11 ' OG ' ' A' ' 38' ' ' SER . 13.6 mt -53.76 171.97 0.08 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.174 -0.466 . . . . 73.040000000000006 110.939 -179.997 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' M' M ' 42' ' ' GLU . . . . . . . . . . . . . 88.3 mt-10 -80.18 107.06 12.66 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.217 -0.447 . . . . 62.509999999999998 110.872 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' M' M ' 43' ' ' ARG . . . . . . . . . . . . . 61.7 mtm180 . . . . . 0 C--N 1.329 -0.3 0 CA-C-N 116.164 -0.471 . . . . 74.109999999999999 110.841 -179.911 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 241' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 262' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 301' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 322' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.126 0 CA-C-O 120.757 0.313 . . . . 53.310000000000002 111.122 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 64.2 m-20 59.84 30.8 20.35 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.233 -0.44 . . . . 74.200000000000003 110.908 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 65.9 mt-30 -67.94 161.17 27.08 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.167 -0.47 . . . . 62.5 110.925 -179.911 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.79 HD22 ' HG2' ' A' ' 8' ' ' GLN . 10.5 mt -127.28 147.71 50.23 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.246 -0.434 . . . . 74.430000000000007 110.916 -179.979 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 29.8 p -110.25 177.07 4.81 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.183 -0.462 . . . . 53.020000000000003 111.128 179.95 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -56.26 -29.51 61.19 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.184 -0.462 . . . . 74.140000000000001 110.859 -179.968 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 21.5 tt0 -67.53 -35.59 79.39 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.179 -0.464 . . . . 74.5 110.907 -179.948 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . 0.79 ' HG2' HD22 ' A' ' 4' ' ' LEU . 1.2 tp-100 -77.28 -42.58 36.47 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.172 -0.467 . . . . 72.230000000000004 110.899 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . 0.668 HG23 HD22 ' A' ' 69' ' ' LEU . 54.6 mt -69.68 -40.12 78.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.252 -0.431 . . . . 42.310000000000002 111.156 179.931 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.63 -26.05 66.74 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.135 -0.484 . . . . 71.310000000000002 111.085 179.847 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 15.4 mm-40 -74.15 -51.93 14.07 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.261 -0.427 . . . . 73.230000000000004 110.867 -179.92 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 16.6 m-85 -69.03 -38.06 78.97 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.213 -0.449 . . . . 65.129999999999995 110.902 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 19.7 ttmt -52.09 -50.38 61.73 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.141 -0.481 . . . . 71.019999999999996 110.928 179.932 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -56.54 -37.25 70.24 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.171 -0.468 . . . . 63.329999999999998 110.885 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -59.6 -25.56 64.72 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.169 -0.469 . . . . 54.420000000000002 111.071 179.952 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 73.8 t80 -70.94 -54.03 12.84 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.215 -0.448 . . . . 64.340000000000003 110.842 -179.895 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 74.9 m -52.79 -31.37 38.23 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.131 -0.486 . . . . 73.329999999999998 110.892 -179.768 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.427 HD23 ' HB3' ' M' ' 38' ' ' SER . 16.3 tp -63.07 -39.93 96.18 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.101 -0.499 . . . . 74.420000000000002 110.902 -179.996 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.645 ' CD1' HG11 ' A' ' 35' ' ' VAL . 33.7 m-85 -79.61 -35.88 38.86 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.213 -0.449 . . . . 71.439999999999998 110.899 179.916 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 16.1 t0 -67.56 98.51 0.68 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.165 -0.47 . . . . 64.040000000000006 110.919 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 3.2 tppt? -70.28 -54.31 13.22 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.209 -0.45 . . . . 72.430000000000007 110.911 -179.96 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 19.3 p-10 -75.73 -10.04 59.1 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.221 -0.445 . . . . 52.409999999999997 110.88 179.848 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 52.18 46.09 56.95 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.732 -0.747 . . . . 60.549999999999997 112.482 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 25.0 p-10 -93.59 -15.75 25.08 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.854 0.359 . . . . 64.510000000000005 110.891 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 100.32 18.04 22.75 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.789 -0.719 . . . . 42.200000000000003 112.479 -179.942 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -154.62 130.82 10.35 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.776 0.322 . . . . 73.510000000000005 111.142 -179.858 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.488 HG22 ' HB2' ' A' ' 32' ' ' LEU . 25.6 mt -94.25 119.84 42.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.205 -0.452 . . . . 74.400000000000006 111.182 179.896 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.661 HG22 ' CG2' ' A' ' 62' ' ' THR . 20.2 p -107.61 176.24 5.22 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.182 -0.463 . . . . 74.239999999999995 111.166 -179.986 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.424 HG23 ' CD1' ' A' ' 52' ' ' ILE . 1.5 p -66.8 -33.95 76.74 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.26 -0.427 . . . . 72.420000000000002 111.14 -179.962 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 45.3 mtmt -61.44 -50.13 74.02 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.237 -0.438 . . . . 74.349999999999994 110.879 179.923 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.553 ' O ' HG23 ' A' ' 35' ' ' VAL . 8.2 mt-10 -76.06 -52.88 9.24 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.244 -0.435 . . . . 72.439999999999998 110.893 179.955 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.488 ' HB2' HG22 ' A' ' 27' ' ' ILE . 3.0 tm? -53.34 -40.67 65.07 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.169 -0.468 . . . . 73.420000000000002 110.922 -179.979 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -70.15 -30.66 69.5 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.785 -0.721 . . . . 45.009999999999998 112.491 179.893 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 96.6 m -74.48 -46.13 41.58 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.771 0.32 . . . . 74.310000000000002 111.12 -179.862 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.645 HG11 ' CD1' ' A' ' 19' ' ' PHE . 47.4 t -51.54 -47.37 36.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.233 -0.44 . . . . 51.420000000000002 111.144 179.892 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . 0.602 ' SD ' HD13 ' M' ' 34' ' ' ILE . 0.0 OUTLIER -56.22 -34.8 66.64 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.2 -0.454 . . . . 73.219999999999999 110.869 179.89 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 42.1 ttt-85 -56.41 -40.36 74.56 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.229 -0.442 . . . . 62.450000000000003 110.911 -179.912 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . 0.681 ' OG ' HD21 ' M' ' 41' ' ' LEU . 5.2 t -76.54 -26.26 54.97 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.181 -0.463 . . . . 72.430000000000007 110.839 -179.807 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 1.011 HD13 ' HB3' ' M' ' 37' ' ' ALA . 60.9 mt -81.48 -21.92 38.4 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.116 -0.493 . . . . 71.099999999999994 110.933 -179.99 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 101.45 31.32 5.57 Favored Glycine 0 N--CA 1.452 -0.251 0 C-N-CA 120.722 -0.751 . . . . 45.140000000000001 112.477 179.856 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 5.7 mm100 -122.62 124.82 44.35 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.796 0.331 . . . . 75.010000000000005 110.923 -179.895 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 1.1 t30 -109.87 76.58 0.97 Allowed Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.603 0.716 . . . . 74.430000000000007 110.911 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.442 ' CG ' HD21 ' A' ' 48' ' ' LEU . 54.2 Cg_endo -69.71 167.97 22.82 Favored 'Trans proline' 0 C--O 1.232 0.177 0 C-N-CA 122.675 2.25 . . . . 72.019999999999996 112.397 179.908 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 20.0 p -110.07 154.14 23.66 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.228 -0.442 . . . . 63.240000000000002 111.138 -179.963 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 20.5 tt0 -51.91 -38.84 57.78 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.222 -0.445 . . . . 64.430000000000007 110.895 -179.994 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.33 -31.61 64.08 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.127 -0.488 . . . . 73.040000000000006 111.075 179.9 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -72.77 -52.6 14.39 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.209 -0.45 . . . . 65.409999999999997 110.895 -179.9 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.456 HD22 HD12 ' A' ' 32' ' ' LEU . 9.3 mt -55.15 -38.39 68.2 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.128 -0.487 . . . . 74.439999999999998 110.928 -179.952 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 17.7 tp60 -64.48 -31.72 73.05 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.145 -0.48 . . . . 71.150000000000006 110.935 179.916 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 26.4 t0 -72.65 -42.11 64.71 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.204 -0.453 . . . . 73.420000000000002 110.864 179.969 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 41.6 mtp -65.71 -57.4 8.12 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.179 -0.464 . . . . 71.239999999999995 110.907 179.963 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.424 ' CD1' HG23 ' A' ' 29' ' ' THR . 62.0 mt -53.27 -45.64 55.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.216 -0.447 . . . . 64.319999999999993 111.155 179.941 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 83.0 m-20 -62.71 -29.76 70.9 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.204 -0.453 . . . . 73.420000000000002 110.891 179.915 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.36 -22.68 61.11 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.221 -0.445 . . . . 72.140000000000001 110.885 -179.983 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 35.7 m -112.96 6.28 8.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.128 -0.487 . . . . 60.25 111.176 179.963 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 30.2 t0 -86.15 97.75 10.51 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.137 -0.483 . . . . 73.420000000000002 110.891 179.923 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.28 -41.35 12.96 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.225 -0.443 . . . . 62.520000000000003 111.064 -179.993 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 57.7 p-10 -85.71 -0.13 54.32 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.197 -0.456 . . . . 74.120000000000005 110.872 -179.993 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 54.27 56.62 20.62 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.731 -0.747 . . . . 73.230000000000004 112.534 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 51.6 p-10 -114.4 -15.74 12.05 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.929 0.395 . . . . 75.120000000000005 110.914 -179.872 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 90.21 18.99 47.92 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.77 -0.729 . . . . 72.109999999999999 112.465 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . 0.661 ' CG2' HG22 ' A' ' 28' ' ' THR . 73.7 p -150.67 163.81 37.63 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.753 0.311 . . . . 74.049999999999997 111.131 -179.881 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 21.7 mt -97.96 111.05 26.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.207 -0.452 . . . . 45.43 111.122 179.909 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -78.43 -172.57 2.93 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.137 -0.483 . . . . 75.120000000000005 110.865 179.875 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.541 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 2.4 t80 -65.41 -57.67 14.17 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.623 0.725 . . . . 63.5 110.891 -179.926 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . 0.541 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 53.6 Cg_endo -69.78 -23.52 30.61 Favored 'Trans proline' 0 N--CA 1.465 -0.148 0 C-N-CA 122.717 2.278 . . . . 54.310000000000002 112.337 -180.0 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 15.2 mt-10 -64.45 -43.09 95.36 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.227 -0.442 . . . . 73.209999999999994 110.856 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 41.0 t80 -71.32 -36.76 71.71 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.148 -0.478 . . . . 72.219999999999999 110.866 -179.897 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.668 HD22 HG23 ' A' ' 9' ' ' ILE . 57.0 tp -70.87 -53.88 13.54 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.123 -0.49 . . . . 63.509999999999998 110.929 -179.98 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.511 HG22 ' O ' ' A' ' 66' ' ' PRO . 12.8 t -59.92 -26.83 66.25 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.148 -0.478 . . . . 54.509999999999998 111.159 179.935 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 10.1 tmm? -63.33 -51.15 67.19 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.201 -0.454 . . . . 70.150000000000006 110.86 179.923 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -50.89 -45.68 60.2 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.252 -0.431 . . . . 74.510000000000005 110.883 179.936 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -75.45 -28.39 59.27 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.194 -0.457 . . . . 63.310000000000002 111.113 179.929 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 31.0 ttm180 -68.53 -18.55 64.38 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.194 -0.457 . . . . 61.439999999999998 110.869 -179.902 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 23.2 pttm -50.49 -30.14 12.13 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.163 -0.472 . . . . 74.310000000000002 110.904 179.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 40.7 mtt -52.5 -28.95 22.57 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.222 -0.445 . . . . 71.219999999999999 110.909 179.841 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 20.6 pttm -142.34 -169.35 2.94 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.216 -0.447 . . . . 74.510000000000005 110.899 179.963 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 63.4 m-20 52.33 73.21 0.35 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.218 -0.446 . . . . 74.239999999999995 110.885 179.831 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . 0.64 HG21 ' H ' ' M' ' 28' ' ' GLN . 1.9 t 178.93 158.67 0.56 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.205 -0.452 . . . . 64.530000000000001 111.127 -179.889 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -173.56 -74.34 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.195 -0.457 . . . . 72.129999999999995 110.896 179.916 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 63.1 m -52.16 -30.02 24.85 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.206 -0.452 . . . . 75.0 110.796 -179.745 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 15.7 tp10 -71.0 -59.27 2.87 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.148 -0.478 . . . . 73.019999999999996 110.914 -179.933 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -52.67 -35.86 55.96 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.151 -0.477 . . . . 64.299999999999997 110.893 -179.993 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -62.9 -39.66 95.21 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.171 -0.468 . . . . 64.239999999999995 110.897 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.762 HG21 HG22 ' A' ' 142' ' ' VAL . 39.1 mt -74.95 -50.75 23.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.166 -0.47 . . . . 74.219999999999999 111.13 -179.985 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 13.9 ttt180 -59.95 -41.72 92.47 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.17 -0.468 . . . . 71.209999999999994 110.867 179.962 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.693 ' O ' HG23 ' A' ' 91' ' ' VAL . 28.3 tt0 -52.11 -47.86 65.06 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.213 -0.449 . . . . 74.540000000000006 110.872 -179.946 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . 0.505 ' HB1' ' CE2' ' A' ' 92' ' ' PHE . . . -74.55 -50.04 19.57 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.134 -0.485 . . . . 75.439999999999998 111.087 179.936 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 4.3 t80 -51.92 -34.53 42.01 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.231 -0.441 . . . . 63.039999999999999 110.838 -179.902 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -72.93 -46.01 54.89 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.156 -0.475 . . . . 73.349999999999994 110.903 -179.884 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . 0.693 HG23 ' O ' ' A' ' 87' ' ' GLU . 65.1 t -61.16 -31.01 48.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.181 -0.463 . . . . 74.5 111.156 179.922 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.697 ' CE1' HG11 ' A' ' 108' ' ' VAL . 21.0 m-85 -86.42 -44.07 12.32 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.156 -0.475 . . . . 74.150000000000006 110.93 179.972 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 44.2 t0 -67.78 87.95 0.24 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.123 -0.489 . . . . 64.310000000000002 110.866 179.979 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 2.3 tppt? -78.56 -47.16 17.79 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.212 -0.449 . . . . 63.43 110.863 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 9.5 p30 -72.65 -9.06 58.16 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.236 -0.438 . . . . 75.420000000000002 110.858 179.901 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 60.35 31.16 73.02 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.729 -0.748 . . . . 62.310000000000002 112.487 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 34.0 p-10 -81.89 -16.15 51.59 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.863 0.363 . . . . 75.230000000000004 110.879 -179.87 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 81.88 18.65 67.22 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.681 -0.771 . . . . 64.329999999999998 112.479 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 14.1 m-85 -142.49 142.93 32.36 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.852 0.358 . . . . 72.25 110.887 -179.808 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 62.3 mt -108.0 130.49 60.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.072 -0.513 . . . . 72.140000000000001 111.13 179.945 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 96.6 p -115.24 -171.76 2.01 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.201 -0.454 . . . . 62.329999999999998 110.86 -179.908 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . 0.607 ' HB2' HG13 ' A' ' 125' ' ' ILE . . . -76.15 -40.12 53.38 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.136 -0.484 . . . . 73.329999999999998 111.079 179.95 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -64.16 -37.95 89.31 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.168 -0.469 . . . . 64.409999999999997 111.106 179.962 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . 0.737 ' O ' HG23 ' A' ' 108' ' ' VAL . 56.6 mt-10 -67.83 -50.27 57.64 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.221 -0.445 . . . . 64.519999999999996 110.885 -179.948 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.554 HD11 HD13 ' M' ' 19' ' ' ILE . 22.1 tp -55.25 -54.86 38.08 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.12 -0.491 . . . . 74.5 110.877 -179.938 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . 0.444 ' O ' HG23 ' A' ' 110' ' ' THR . 37.0 ttp180 -52.24 -44.81 65.04 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.224 -0.443 . . . . 75.319999999999993 110.884 179.971 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 67.3 t60 -59.48 -34.38 72.5 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.149 -0.478 . . . . 70.510000000000005 110.892 179.969 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.737 HG23 ' O ' ' A' ' 104' ' ' GLU . 21.7 t -74.49 -52.37 19.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.196 -0.456 . . . . 64.310000000000002 111.142 179.977 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . 0.747 ' HG2' HD11 ' A' ' 116' ' ' LEU . 0.3 OUTLIER -60.41 -41.94 94.97 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.148 -0.478 . . . . 73.140000000000001 110.901 179.896 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . 0.444 HG23 ' O ' ' A' ' 106' ' ' ARG . 11.3 p -53.51 -32.35 50.0 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.192 -0.458 . . . . 74.430000000000007 111.088 -179.936 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 22.6 t-20 -74.6 -29.41 61.3 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.243 -0.435 . . . . 74.420000000000002 110.876 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 2.1 mt -70.68 -24.36 62.66 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.219 -0.446 . . . . 64.140000000000001 110.905 179.944 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 101.02 32.93 5.14 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.765 -0.731 . . . . 64.030000000000001 112.531 179.924 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -112.4 114.54 27.31 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.917 0.389 . . . . 71.510000000000005 110.874 -179.832 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 3.2 ttpm? -64.61 123.35 19.07 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.158 -0.474 . . . . 64.219999999999999 110.881 179.947 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.747 HD11 ' HG2' ' A' ' 109' ' ' MET . 8.5 mt -141.34 155.79 45.91 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.181 -0.463 . . . . 70.340000000000003 110.926 179.901 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 30.3 p -118.87 167.47 11.68 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.227 -0.442 . . . . 54.399999999999999 111.177 179.911 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 69.8 m-20 -51.98 -37.53 53.43 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.218 -0.447 . . . . 73.329999999999998 110.852 179.927 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -72.67 -34.85 67.5 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.2 -0.454 . . . . 74.439999999999998 110.881 -179.891 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -64.91 -45.87 84.1 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.178 -0.465 . . . . 61.43 110.842 -179.917 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.487 ' CG1' ' HB1' ' A' ' 102' ' ' ALA . 88.9 t -56.21 -30.65 30.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.179 -0.464 . . . . 63.329999999999998 111.153 179.98 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 54.8 t0 -66.52 -45.67 78.73 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.173 -0.467 . . . . 73.140000000000001 110.864 179.921 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -55.82 -29.48 59.86 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.213 -0.449 . . . . 72.109999999999999 110.906 -179.914 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 25.1 mtp -75.76 -59.51 2.72 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.171 -0.468 . . . . 74.530000000000001 110.896 179.935 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.607 HG13 ' HB2' ' A' ' 102' ' ' ALA . 34.2 mm -54.08 -35.61 29.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.243 -0.435 . . . . 64.420000000000002 111.156 179.981 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 4.9 tmm_? -66.3 -31.72 72.69 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.135 -0.484 . . . . 75.299999999999997 110.873 179.953 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -70.67 -48.22 55.93 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.231 -0.44 . . . . 74.239999999999995 110.897 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.543 ' HB3' ' CG2' ' A' ' 136' ' ' VAL . . . -73.12 -33.05 65.32 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.175 -0.466 . . . . 43.439999999999998 111.1 179.931 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 50.6 t0 -69.18 86.31 0.39 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.196 -0.456 . . . . 71.400000000000006 110.898 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . 0.669 HD12 ' HG2' ' A' ' 140' ' ' GLU . 3.5 mt -79.95 -45.24 22.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.219 -0.446 . . . . 62.25 111.131 179.998 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 23.3 p30 -72.65 -8.9 57.6 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.188 -0.46 . . . . 74.030000000000001 110.881 179.855 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 62.94 45.36 95.82 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.747 -0.74 . . . . 52.420000000000002 112.506 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 31.6 p-10 -91.65 -16.15 27.46 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.894 0.378 . . . . 73.129999999999995 110.885 -179.957 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 101.94 3.8 51.7 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.73 -0.747 . . . . 64.409999999999997 112.489 -179.937 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 5.8 tt0 -149.34 172.31 15.11 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.832 0.349 . . . . 71.120000000000005 110.917 -179.882 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 136' ' ' VAL . . . . . 0.543 ' CG2' ' HB3' ' A' ' 128' ' ' ALA . 67.8 t -115.55 114.29 45.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.185 -0.461 . . . . 65.340000000000003 111.099 179.967 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 48.4 p-10 -94.01 -172.41 2.83 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.123 -0.489 . . . . 70.129999999999995 110.899 179.979 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . 0.732 ' O ' HG23 ' A' ' 142' ' ' VAL . 47.5 t80 -68.46 -49.26 61.15 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.185 -0.461 . . . . 74.140000000000001 110.918 -179.927 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -51.63 -46.68 63.73 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.172 -0.467 . . . . 64.510000000000005 110.884 179.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . 0.669 ' HG2' HD12 ' A' ' 130' ' ' ILE . 97.5 mt-10 -70.87 -40.86 72.03 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.162 -0.472 . . . . 72.109999999999999 110.929 -179.949 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 88.0 t80 -59.68 -35.5 74.58 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.12 -0.491 . . . . 70.319999999999993 110.917 -179.969 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . 0.762 HG22 HG21 ' A' ' 85' ' ' ILE . 94.2 t -64.1 -37.52 80.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.104 -0.498 . . . . 33.329999999999998 111.112 -179.99 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 16.4 tm0? -70.34 -33.13 71.11 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.152 -0.477 . . . . 64.409999999999997 110.951 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 8.8 tpt -74.71 -56.31 4.93 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.225 -0.443 . . . . 71.140000000000001 110.885 179.919 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 5.0 ttm -60.54 -27.91 68.02 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.216 -0.447 . . . . 73.430000000000007 110.906 179.952 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 2.5 m -111.42 21.33 16.34 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.209 -0.45 . . . . 63.409999999999997 111.116 -179.924 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -51.68 114.27 1.22 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.182 -0.463 . . . . 51.450000000000003 111.112 179.819 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 8.5 mtmp? . . . . . 0 C--N 1.329 -0.325 0 CA-C-N 116.244 -0.434 . . . . 74.439999999999998 110.873 179.975 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' M' M ' 8' ' ' LEU . . . . . . . . . . . . . 26.6 mt . . . . . 0 C--O 1.231 0.1 0 CA-C-O 120.795 0.331 . . . . 74.219999999999999 110.93 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' M' M ' 9' ' ' SER . . . . . . . . . . . . . 11.2 t -57.99 116.19 3.35 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.172 -0.467 . . . . 43.32 110.862 -179.892 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' M' M ' 10' ' ' GLY . . . . . . . . . . . . . . . -130.16 35.33 2.54 Favored Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.74 -0.743 . . . . 51.549999999999997 112.453 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' M' M ' 11' ' ' GLY . . . . . . . . . . . . . . . -80.42 -112.56 0.29 Allowed Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.761 -0.733 . . . . 63.210000000000001 112.497 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' M' M ' 12' ' ' GLU . . . . . . . . . . . . . 15.1 pt-20 -95.38 179.25 5.23 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.853 0.359 . . . . 70.219999999999999 110.917 -179.873 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' M' M ' 13' ' ' LEU . . . . . 0.596 HD11 ' HG2' ' M' ' 15' ' ' LYS . 17.4 tp -53.76 106.82 0.2 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.179 -0.464 . . . . 70.530000000000001 110.956 179.991 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' M' M ' 14' ' ' ASP . . . . . . . . . . . . . 28.8 t0 -101.1 68.83 1.26 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.208 -0.451 . . . . 63.229999999999997 110.845 179.85 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' M' M ' 15' ' ' LYS . . . . . 0.596 ' HG2' HD11 ' M' ' 13' ' ' LEU . 19.2 mtmm -52.61 -46.58 67.07 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.151 -0.477 . . . . 70.150000000000006 110.894 179.975 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' M' M ' 16' ' ' TRP . . . . . 0.783 ' CE3' HD12 ' M' ' 19' ' ' ILE . 17.9 m95 -52.06 -47.21 65.23 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.251 -0.432 . . . . 71.310000000000002 110.943 179.934 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' M' M ' 17' ' ' GLU . . . . . . . . . . . . . 18.1 tt0 -57.47 -26.22 60.92 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.282 -0.417 . . . . 74.510000000000005 110.892 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' M' M ' 18' ' ' LYS . . . . . . . . . . . . . 6.0 ttpm? -73.06 -25.8 61.05 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.11 -0.496 . . . . 73.319999999999993 110.885 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' M' M ' 19' ' ' ILE . . . . . 0.783 HD12 ' CE3' ' M' ' 16' ' ' TRP . 28.7 mt -76.64 -21.79 14.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.253 -0.431 . . . . 45.450000000000003 111.116 179.896 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' M' M ' 20' ' ' ARG . . . . . . . . . . . . . 43.1 ttt180 -51.69 -39.82 58.97 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.187 -0.46 . . . . 74.310000000000002 110.859 179.931 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' M' M ' 21' ' ' LEU . . . . . . . . . . . . . 4.5 mt 53.57 -172.26 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.176 -0.465 . . . . 72.340000000000003 110.948 -179.901 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' M' M ' 22' ' ' ARG . . . . . . . . . . . . . 49.7 ttm-85 -106.45 136.83 19.33 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.558 0.694 . . . . 70.450000000000003 110.895 179.963 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' M' M ' 23' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.78 163.63 37.56 Favored 'Trans proline' 0 C--N 1.341 0.149 0 C-N-CA 122.704 2.269 . . . . 61.32 112.308 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' M' M ' 24' ' ' GLY . . . . . . . . . . . . . . . -141.86 -85.93 0.09 OUTLIER Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.742 -0.742 . . . . 73.310000000000002 112.54 179.948 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' M' M ' 25' ' ' GLY . . . . . . . . . . . . . . . -77.12 148.73 34.9 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.751 -0.738 . . . . 51.140000000000001 112.483 -179.909 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' M' M ' 26' ' ' LYS . . . . . 0.464 ' O ' HG23 ' A' ' 79' ' ' THR . 15.4 mmtp -136.29 65.72 1.51 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.845 0.355 . . . . 73.120000000000005 110.907 -179.924 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' M' M ' 27' ' ' LYS . . . . . . . . . . . . . 14.9 mtpp -147.03 78.63 1.49 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.265 -0.425 . . . . 75.310000000000002 110.893 179.868 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' M' M ' 28' ' ' GLN . . . . . 0.64 ' H ' HG21 ' A' ' 79' ' ' THR . 36.4 tp60 -178.41 120.98 0.09 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.248 -0.433 . . . . 74.519999999999996 110.93 179.969 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' M' M ' 29' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -67.77 -177.44 0.79 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.189 -0.46 . . . . 75.430000000000007 110.933 -179.873 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' M' M ' 30' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -124.06 27.4 7.17 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.108 -0.496 . . . . 74.329999999999998 110.878 179.908 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' M' M ' 31' ' ' LEU . . . . . 0.665 HD12 HD12 ' M' ' 34' ' ' ILE . 12.3 tp -136.73 -41.25 0.61 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.226 -0.443 . . . . 51.119999999999997 110.924 179.886 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' M' M ' 32' ' ' LYS . . . . . . . . . . . . . 12.2 ptmm? -47.13 -42.15 18.79 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.247 -0.433 . . . . 64.239999999999995 110.911 179.791 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' M' M ' 33' ' ' HIS . . . . . . . . . . . . . 19.4 t60 -49.12 -44.4 42.33 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.218 -0.446 . . . . 73.430000000000007 110.843 179.871 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' M' M ' 34' ' ' ILE . . . . . 0.665 HD12 HD12 ' M' ' 31' ' ' LEU . 77.7 mt -51.54 -38.34 20.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.199 -0.455 . . . . 52.240000000000002 111.168 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' M' M ' 35' ' ' VAL . . . . . . . . . . . . . 38.1 t -50.14 -39.17 15.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.195 -0.457 . . . . 73.519999999999996 111.08 179.872 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' M' M ' 36' ' ' TRP . . . . . . . . . . . . . 22.5 m0 -59.06 -39.13 81.11 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.182 -0.463 . . . . 75.219999999999999 110.907 179.966 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' M' M ' 37' ' ' ALA . . . . . 1.011 ' HB3' HD13 ' A' ' 39' ' ' LEU . . . -64.22 -18.52 64.59 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.222 -0.445 . . . . 72.040000000000006 111.099 179.939 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' M' M ' 38' ' ' SER . . . . . 0.427 ' HB3' HD23 ' A' ' 18' ' ' LEU . 0.7 OUTLIER -73.13 -17.87 61.35 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.215 -0.448 . . . . 61.240000000000002 110.817 -179.744 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' M' M ' 39' ' ' ARG . . . . . . . . . . . . . 1.4 tpt180 -58.68 -25.6 63.0 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.165 -0.47 . . . . 74.510000000000005 110.897 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' M' M ' 40' ' ' GLU . . . . . . . . . . . . . 2.4 pt-20 -87.07 -27.89 22.88 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.142 -0.481 . . . . 72.219999999999999 110.894 -179.939 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' M' M ' 41' ' ' LEU . . . . . 0.681 HD21 ' OG ' ' A' ' 38' ' ' SER . 11.3 mt -82.21 131.14 35.23 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.147 -0.478 . . . . 72.239999999999995 110.923 179.993 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' M' M ' 42' ' ' GLU . . . . . . . . . . . . . 75.4 tt0 -168.34 142.64 3.34 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.166 -0.47 . . . . 74.420000000000002 110.836 179.92 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' M' M ' 43' ' ' ARG . . . . . . . . . . . . . 19.8 ptt180 . . . . . 0 C--N 1.33 -0.278 0 CA-C-N 116.11 -0.496 . . . . 74.120000000000005 110.905 -179.962 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 241' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 262' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 301' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 322' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.1 0 CA-C-O 120.826 0.346 . . . . 71.439999999999998 111.074 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 19.8 m-20 -134.27 139.4 45.7 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.207 -0.451 . . . . 75.439999999999998 110.832 -179.97 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 14.5 pt20 -138.36 169.85 17.07 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.181 -0.463 . . . . 63.130000000000003 110.895 -179.897 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.519 HD12 HG13 ' A' ' 9' ' ' ILE . 2.8 mm? -84.83 109.31 18.01 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.18 -0.463 . . . . 73.219999999999999 110.904 179.995 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.739 ' O ' HD12 ' A' ' 9' ' ' ILE . 27.4 p -111.07 171.69 7.32 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.204 -0.453 . . . . 71.340000000000003 111.146 179.914 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 9.7 tt0 -52.17 -45.22 65.02 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.219 -0.446 . . . . 74.439999999999998 110.884 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -61.39 -26.77 68.07 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.135 -0.484 . . . . 73.200000000000003 110.9 -179.91 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . 0.459 ' CG ' HD13 ' A' ' 4' ' ' LEU . 24.6 tt0 -77.92 -57.46 3.79 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.162 -0.472 . . . . 74.420000000000002 110.904 -179.968 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . 0.739 HD12 ' O ' ' A' ' 5' ' ' THR . 3.2 mp -62.66 -52.33 61.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.235 -0.439 . . . . 75.219999999999999 111.077 -179.976 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -52.0 -33.76 39.74 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.187 -0.461 . . . . 74.450000000000003 111.114 179.8 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -74.9 -51.66 13.28 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.192 -0.458 . . . . 72.209999999999994 110.864 -179.897 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 16.5 m-85 -58.2 -42.22 85.69 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.17 -0.468 . . . . 53.310000000000002 110.891 -179.899 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -51.91 -37.85 54.04 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.131 -0.486 . . . . 72.409999999999997 110.892 179.986 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 -66.13 -35.83 81.52 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.252 -0.431 . . . . 50.130000000000003 110.831 179.978 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -65.63 -41.06 93.08 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.164 -0.471 . . . . 73.140000000000001 111.078 179.943 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.406 ' CE1' HD11 ' A' ' 27' ' ' ILE . 85.3 t80 -53.4 -51.58 62.1 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.253 -0.43 . . . . 72.439999999999998 110.881 -179.927 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 14.7 p -53.23 -32.71 49.63 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.176 -0.465 . . . . 64.439999999999998 110.857 -179.824 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 17.5 tp -64.58 -38.92 92.68 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.141 -0.481 . . . . 74.25 110.879 -179.991 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.642 ' CE1' HG11 ' A' ' 35' ' ' VAL . 48.1 m-85 -82.04 -27.65 32.92 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.233 -0.44 . . . . 75.120000000000005 110.888 179.966 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -82.83 98.56 9.21 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.164 -0.471 . . . . 54.25 110.835 179.962 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 40.4 mmtt -69.91 -54.14 14.73 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.197 -0.456 . . . . 73.349999999999994 110.878 179.969 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 22.3 p-10 -77.2 -10.12 59.21 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.215 -0.448 . . . . 72.310000000000002 110.879 179.879 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 52.02 42.26 54.07 Favored Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.726 -0.75 . . . . 73.409999999999997 112.453 -179.959 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 29.9 p-10 -88.57 -15.66 34.53 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.872 0.367 . . . . 71.109999999999999 110.882 -179.998 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 105.4 -11.74 47.36 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.723 -0.751 . . . . 74.120000000000005 112.463 -179.965 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 34.0 p -125.8 130.78 52.1 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.723 0.297 . . . . 54.43 111.168 -179.818 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.532 HG22 ' HB2' ' A' ' 32' ' ' LEU . 25.0 mt -98.58 125.98 51.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.241 -0.436 . . . . 74.439999999999998 111.108 179.969 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.762 HG22 HG22 ' A' ' 62' ' ' THR . 73.9 p -111.41 -178.51 3.47 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.188 -0.46 . . . . 72.310000000000002 111.1 -179.998 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.521 HG23 ' CD1' ' A' ' 52' ' ' ILE . 2.0 p -66.57 -26.76 67.27 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.214 -0.448 . . . . 71.239999999999995 111.147 -179.966 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 2.2 tppp? -75.07 -50.19 17.25 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.224 -0.444 . . . . 71.409999999999997 110.883 179.878 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 28.4 mt-10 -71.32 -40.38 70.8 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.266 -0.425 . . . . 74.150000000000006 110.843 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.532 ' HB2' HG22 ' A' ' 27' ' ' ILE . 3.9 tt -74.07 -49.19 25.18 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.199 -0.455 . . . . 61.229999999999997 110.921 -179.988 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -54.25 -27.94 41.13 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.771 -0.728 . . . . 73.010000000000005 112.453 179.93 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 95.1 m -68.97 -53.47 20.53 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.827 0.346 . . . . 75.140000000000001 111.095 -179.828 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.642 HG11 ' CE1' ' A' ' 19' ' ' PHE . 39.2 t -51.76 -51.42 27.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.223 -0.444 . . . . 60.409999999999997 111.172 179.89 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 7.5 mtt -54.21 -49.14 70.09 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.126 -0.488 . . . . 71.319999999999993 110.859 179.94 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 2.6 tmt_? -59.1 -42.6 90.87 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.205 -0.452 . . . . 62.210000000000001 110.887 -179.929 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . 0.632 ' OG ' HD21 ' M' ' 41' ' ' LEU . 4.2 t -57.5 -29.9 64.68 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.14 -0.482 . . . . 72.409999999999997 110.859 -179.785 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.992 HD13 ' HB3' ' M' ' 37' ' ' ALA . 9.3 mt -91.91 -4.38 54.78 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.13 -0.486 . . . . 74.109999999999999 110.957 179.988 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 101.42 -13.15 58.4 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.738 -0.744 . . . . 73.150000000000006 112.523 179.943 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -81.48 96.27 7.35 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.855 0.359 . . . . 71.420000000000002 110.917 -179.883 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 6.4 t-20 -109.74 82.67 2.4 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.672 0.749 . . . . 62.210000000000001 110.874 -179.952 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.8 168.05 22.72 Favored 'Trans proline' 0 C--N 1.342 0.187 0 C-N-CA 122.719 2.279 . . . . 45.32 112.332 179.949 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 20.0 p -83.98 158.35 21.55 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.224 -0.443 . . . . 72.310000000000002 111.128 -179.947 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 15.1 mp0 -51.97 -48.36 64.38 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.228 -0.442 . . . . 60.0 110.914 179.98 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.78 -31.55 72.59 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.159 -0.473 . . . . 63.409999999999997 111.062 179.967 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -68.28 -52.0 38.73 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.259 -0.428 . . . . 74.439999999999998 110.915 -179.908 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 25.3 mt -55.09 -48.67 73.24 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.122 -0.49 . . . . 72.040000000000006 110.904 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 17.5 tp60 -54.4 -29.43 48.93 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.212 -0.449 . . . . 64.5 110.91 179.932 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . 0.73 ' OD2' HG21 ' A' ' 146' ' ' THR . 46.1 t0 -74.49 -29.53 61.46 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.189 -0.46 . . . . 73.420000000000002 110.862 179.989 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . 0.622 ' HE2' HD13 ' M' ' 31' ' ' LEU . 41.5 mtp -73.14 -58.06 3.58 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.174 -0.467 . . . . 70.340000000000003 110.857 -179.974 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.521 ' CD1' HG23 ' A' ' 29' ' ' THR . 62.0 mt -53.32 -52.75 28.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.22 -0.446 . . . . 72.200000000000003 111.105 179.981 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 78.4 m-20 -57.0 -25.28 58.21 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.236 -0.438 . . . . 71.519999999999996 110.894 179.967 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -75.54 -28.33 59.02 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.145 -0.48 . . . . 63.240000000000002 110.87 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 9.8 m -109.81 10.87 8.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.164 -0.471 . . . . 60.530000000000001 111.104 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 28.8 t0 -86.69 99.99 12.15 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.199 -0.455 . . . . 62.039999999999999 110.869 179.89 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.3 -46.87 8.85 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.163 -0.471 . . . . 70.349999999999994 111.126 179.911 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 50.7 p30 -81.63 -0.3 41.84 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.226 -0.443 . . . . 71.340000000000003 110.88 -179.998 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 55.26 55.47 28.19 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.734 -0.746 . . . . 43.0 112.517 -179.916 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 50.3 p-10 -114.55 -15.76 11.97 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.863 0.363 . . . . 43.329999999999998 110.872 -179.858 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 89.39 20.46 44.98 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.705 -0.76 . . . . 64.329999999999998 112.527 -179.981 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . 0.762 HG22 HG22 ' A' ' 28' ' ' THR . 71.4 p -150.49 161.1 43.18 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.723 0.296 . . . . 73.040000000000006 111.117 -179.814 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.429 HG21 ' HD1' ' A' ' 68' ' ' PHE . 22.9 mt -98.98 114.59 37.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.214 -0.448 . . . . 71.409999999999997 111.151 179.882 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.4 t0 -82.33 -172.84 4.22 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.213 -0.449 . . . . 74.439999999999998 110.86 179.902 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.529 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 2.4 t80 -65.1 -58.21 13.23 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.65 0.738 . . . . 65.140000000000001 110.867 -179.89 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . 0.529 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 53.9 Cg_endo -69.74 -24.26 29.98 Favored 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.674 2.25 . . . . 52.229999999999997 112.315 -179.968 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 75.9 mt-10 -65.29 -41.78 93.8 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.254 -0.43 . . . . 73.129999999999995 110.917 -179.964 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . 0.429 ' HD1' HG21 ' A' ' 63' ' ' ILE . 26.5 t80 -72.54 -36.11 68.19 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.148 -0.478 . . . . 63.520000000000003 110.863 -179.932 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 50.2 tp -68.98 -53.67 19.39 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.137 -0.483 . . . . 74.349999999999994 110.901 -179.973 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 13.3 t -58.44 -26.67 63.58 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.242 -0.436 . . . . 64.329999999999998 111.137 179.936 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 5.3 tmm? -62.25 -50.41 71.84 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.243 -0.435 . . . . 72.319999999999993 110.868 179.94 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 1.2 mmt -51.61 -45.39 63.2 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.215 -0.448 . . . . 74.219999999999999 110.88 179.951 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -75.03 -28.58 60.53 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.238 -0.437 . . . . 61.229999999999997 111.1 179.967 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 19.5 tpp180 -67.48 -18.0 64.9 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.18 -0.464 . . . . 73.209999999999994 110.891 -179.929 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 8.4 pttp -50.41 -29.62 10.58 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.168 -0.469 . . . . 74.109999999999999 110.886 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 88.4 mmm -51.45 -29.88 17.69 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.212 -0.449 . . . . 74.430000000000007 110.854 179.881 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 7.9 ptpt -178.94 111.89 0.06 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.251 -0.431 . . . . 63.100000000000001 110.891 179.922 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 10.8 t70 -144.7 -68.62 0.31 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.241 -0.436 . . . . 73.099999999999994 110.858 179.883 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 1.7 m -121.15 137.7 54.55 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.204 -0.453 . . . . 55.399999999999999 111.146 -179.883 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -112.2 -35.66 5.56 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.217 -0.447 . . . . 42.240000000000002 110.854 179.929 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 1.1 m -54.4 -33.6 59.6 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.227 -0.442 . . . . 71.140000000000001 110.852 -179.763 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 11.1 tp10 -60.98 -52.74 63.74 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.155 -0.475 . . . . 71.129999999999995 110.933 -179.979 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -53.18 -37.24 61.74 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.144 -0.48 . . . . 74.010000000000005 110.858 -179.919 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 15.8 tt0 -60.92 -33.57 73.35 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.147 -0.479 . . . . 65.349999999999994 110.873 -179.916 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.462 HG23 ' CE1' ' A' ' 141' ' ' PHE . 61.9 mt -70.23 -44.86 77.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.156 -0.475 . . . . 42.399999999999999 111.142 179.961 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 53.6 ttp180 -72.02 -32.92 67.63 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.193 -0.458 . . . . 74.129999999999995 110.871 179.975 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 24.9 mm-40 -76.56 -48.29 19.78 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.165 -0.471 . . . . 74.409999999999997 110.939 -179.975 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -53.37 -43.01 67.44 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.182 -0.463 . . . . 74.340000000000003 111.122 179.883 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.402 ' CD1' HD11 ' A' ' 100' ' ' ILE . 36.0 t80 -52.01 -37.28 52.76 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.244 -0.434 . . . . 71.109999999999999 110.875 -179.937 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 3.4 tmt_? -71.0 -38.67 72.66 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.128 -0.487 . . . . 74.329999999999998 110.845 -179.888 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 31.5 t -62.21 -48.13 89.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.196 -0.456 . . . . 75.420000000000002 111.13 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.496 ' CE1' HG11 ' A' ' 108' ' ' VAL . 9.9 m-85 -68.3 -26.3 65.57 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.186 -0.461 . . . . 73.150000000000006 110.875 -179.987 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 37.6 t0 -72.84 92.81 1.63 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.151 -0.477 . . . . 75.409999999999997 110.873 179.948 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 34.4 ttmt -78.57 -51.02 10.53 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.192 -0.458 . . . . 62.299999999999997 110.882 179.985 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 24.0 p30 -72.44 -9.1 58.11 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.228 -0.442 . . . . 61.329999999999998 110.866 179.87 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 60.0 29.37 67.86 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.779 -0.724 . . . . 70.120000000000005 112.482 -179.951 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 42.6 p-10 -82.98 -16.15 48.37 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.91 0.386 . . . . 73.430000000000007 110.908 -179.884 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 93.66 18.7 37.13 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.709 -0.757 . . . . 74.209999999999994 112.469 179.965 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 21.8 m-85 -139.26 165.56 26.86 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.884 0.373 . . . . 74.299999999999997 110.909 -179.799 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.402 HD11 ' CD1' ' A' ' 89' ' ' PHE . 77.5 mt -122.37 114.56 43.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.135 -0.484 . . . . 62.329999999999998 111.126 179.91 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 4.9 p -102.52 174.93 5.68 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.174 -0.466 . . . . 72.530000000000001 110.906 -179.927 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . 0.54 ' HB2' HG13 ' A' ' 125' ' ' ILE . . . -67.73 -30.2 69.62 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.191 -0.459 . . . . 61.009999999999998 111.124 179.889 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -68.13 -43.91 77.27 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.17 -0.468 . . . . 34.32 111.15 179.912 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 91.0 mt-10 -74.13 -47.68 34.52 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.193 -0.458 . . . . 71.439999999999998 110.875 -179.934 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 34.8 tp -53.86 -49.78 67.72 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.159 -0.473 . . . . 73.209999999999994 110.916 -179.944 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . 0.471 ' HB2' HG21 ' A' ' 121' ' ' VAL . 26.3 ttt180 -52.25 -41.62 62.96 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.191 -0.458 . . . . 52.409999999999997 110.876 179.923 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 27.3 t60 -59.74 -34.47 72.99 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.232 -0.44 . . . . 75.209999999999994 110.903 179.984 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.496 HG11 ' CE1' ' A' ' 92' ' ' PHE . 38.3 t -66.86 -45.71 86.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.193 -0.458 . . . . 53.140000000000001 111.153 179.956 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . 0.471 ' HB3' HD12 ' A' ' 116' ' ' LEU . 3.4 mmt -60.59 -37.0 79.91 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.186 -0.461 . . . . 63.409999999999997 110.85 179.939 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 2.1 m -55.03 -34.33 63.41 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.236 -0.438 . . . . 71.040000000000006 111.152 -179.948 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 4.9 t-20 -70.96 -30.69 67.05 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.22 -0.446 . . . . 62.409999999999997 110.87 179.974 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.434 HD13 ' HE2' ' M' ' 18' ' ' LYS . 18.1 mt -73.01 -26.28 61.27 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.189 -0.46 . . . . 63.229999999999997 110.918 179.967 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 99.9 30.13 6.56 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.767 -0.73 . . . . 52.439999999999998 112.465 179.874 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -115.14 112.69 22.94 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.915 0.388 . . . . 62.310000000000002 110.87 -179.876 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.57 119.77 12.28 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.127 -0.488 . . . . 62.219999999999999 110.87 179.951 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.471 HD12 ' HB3' ' A' ' 109' ' ' MET . 7.8 mt -140.49 155.82 46.54 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.215 -0.448 . . . . 74.140000000000001 110.891 179.883 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . 0.631 ' O ' HG23 ' A' ' 121' ' ' VAL . 52.5 p -115.03 170.54 8.27 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.181 -0.463 . . . . 74.109999999999999 111.141 179.958 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 20.6 m-20 -58.71 -33.21 69.94 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.215 -0.448 . . . . 75.409999999999997 110.857 179.909 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 22.5 tp10 -75.68 -33.46 60.39 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.184 -0.462 . . . . 72.340000000000003 110.865 -179.882 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 13.7 tt0 -71.15 -31.77 68.12 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.171 -0.468 . . . . 61.350000000000001 110.856 -179.914 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.631 HG23 ' O ' ' A' ' 117' ' ' THR . 43.5 t -71.27 -31.96 45.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.187 -0.461 . . . . 63.409999999999997 111.153 179.963 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 12.2 t0 -51.98 -46.86 65.02 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.137 -0.483 . . . . 65.340000000000003 110.811 179.954 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 20.6 tp10 -55.82 -29.33 59.6 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.214 -0.448 . . . . 71.510000000000005 110.877 -179.859 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 71.7 mtp -75.55 -59.48 2.73 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.144 -0.48 . . . . 73.040000000000006 110.903 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.54 HG13 ' HB2' ' A' ' 102' ' ' ALA . 35.9 mm -53.93 -35.7 28.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.243 -0.435 . . . . 61.329999999999998 111.165 179.898 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 56.8 ttt180 -63.49 -31.85 73.13 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.152 -0.476 . . . . 73.129999999999995 110.915 179.932 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -74.66 -52.37 11.83 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.139 -0.482 . . . . 74.329999999999998 110.864 -179.892 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.673 ' HB3' HG22 ' A' ' 136' ' ' VAL . . . -65.23 -34.49 78.48 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.102 -0.499 . . . . 55.43 111.099 179.925 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 49.4 t0 -68.45 86.74 0.3 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.26 -0.427 . . . . 70.430000000000007 110.864 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 55.2 mt -79.83 -46.13 22.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.166 -0.47 . . . . 72.140000000000001 111.141 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 21.3 p30 -72.8 -8.74 56.94 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.181 -0.463 . . . . 65.540000000000006 110.875 179.864 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 62.76 42.59 99.66 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.703 -0.761 . . . . 74.129999999999995 112.476 -179.917 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 34.6 p-10 -87.58 -16.0 35.8 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.864 0.364 . . . . 71.340000000000003 110.919 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 104.12 2.37 45.11 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.745 -0.741 . . . . 74.439999999999998 112.431 -179.988 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 4.0 tt0 -149.16 172.27 15.09 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.901 0.382 . . . . 73.409999999999997 110.894 -179.921 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 136' ' ' VAL . . . . . 0.673 HG22 ' HB3' ' A' ' 128' ' ' ALA . 99.3 t -107.33 111.25 34.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.21 -0.45 . . . . 51.219999999999999 111.127 179.98 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 19.0 p30 -92.11 165.59 13.08 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.15 -0.477 . . . . 74.150000000000006 110.881 -179.993 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . 0.43 ' O ' HG23 ' A' ' 142' ' ' VAL . 37.0 t80 -52.01 -46.89 65.15 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.162 -0.472 . . . . 64.329999999999998 110.983 -179.919 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 15.3 tt0 -51.94 -42.14 62.6 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.077 -0.51 . . . . 65.340000000000003 110.943 179.965 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 23.7 mt-10 -76.52 -34.27 58.58 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.108 -0.497 . . . . 71.409999999999997 110.92 -179.951 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . 0.462 ' CE1' HG23 ' A' ' 85' ' ' ILE . 43.2 t80 -65.74 -38.93 90.48 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.121 -0.49 . . . . 54.420000000000002 110.855 -179.897 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . 0.43 HG23 ' O ' ' A' ' 138' ' ' TYR . 98.9 t -71.34 -40.6 73.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.121 -0.491 . . . . 64.299999999999997 111.123 -179.989 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 24.4 tt0 -70.83 -45.31 64.78 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.173 -0.467 . . . . 61.100000000000001 110.911 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 11.4 tpt -65.0 -26.2 68.19 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.172 -0.467 . . . . 73.049999999999997 110.87 180.0 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 145' ' ' MET . . . . . 0.447 ' HE1' HG22 ' M' ' 19' ' ' ILE . 6.4 ttm -87.61 -39.47 15.04 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.25 -0.432 . . . . 64.530000000000001 110.887 179.916 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 146' ' ' THR . . . . . 0.73 HG21 ' OD2' ' A' ' 50' ' ' ASP . 2.6 m -96.6 21.31 9.5 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.197 -0.456 . . . . 72.430000000000007 111.113 -179.87 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -51.7 143.36 12.91 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.235 -0.438 . . . . 64.150000000000006 111.118 179.807 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 18.9 tptm . . . . . 0 C--N 1.329 -0.295 0 CA-C-N 116.234 -0.439 . . . . 71.310000000000002 110.949 179.935 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' M' M ' 8' ' ' LEU . . . . . . . . . . . . . 19.7 tp . . . . . 0 C--O 1.231 0.086 0 CA-C-O 120.821 0.343 . . . . 65.099999999999994 110.9 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' M' M ' 9' ' ' SER . . . . . . . . . . . . . 6.2 t 53.44 87.0 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.138 -0.483 . . . . 73.099999999999994 110.868 -179.945 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' M' M ' 10' ' ' GLY . . . . . . . . . . . . . . . -82.18 -113.16 0.43 Allowed Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.783 -0.722 . . . . 73.25 112.45 -179.964 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' M' M ' 11' ' ' GLY . . . . . . . . . . . . . . . 106.34 -30.65 9.25 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.688 -0.768 . . . . 73.299999999999997 112.484 -179.891 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' M' M ' 12' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -111.53 -179.12 3.62 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.895 0.378 . . . . 74.230000000000004 110.882 -179.852 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' M' M ' 13' ' ' LEU . . . . . 0.703 HD23 ' CD1' ' M' ' 16' ' ' TRP . 28.8 tp -63.88 136.33 57.29 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.179 -0.464 . . . . 75.140000000000001 110.889 -179.937 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' M' M ' 14' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -84.02 -27.81 28.11 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.192 -0.458 . . . . 70.439999999999998 110.878 179.829 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' M' M ' 15' ' ' LYS . . . . . . . . . . . . . 44.7 mttp -60.16 -56.88 16.12 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.212 -0.449 . . . . 62.450000000000003 110.888 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' M' M ' 16' ' ' TRP . . . . . 0.703 ' CD1' HD23 ' M' ' 13' ' ' LEU . 10.2 m95 -54.09 -39.03 65.96 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.241 -0.436 . . . . 71.019999999999996 110.919 179.923 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' M' M ' 17' ' ' GLU . . . . . . . . . . . . . 15.3 tm-20 -56.9 -27.8 61.15 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.227 -0.442 . . . . 74.420000000000002 110.872 -179.929 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' M' M ' 18' ' ' LYS . . . . . 0.434 ' HE2' HD13 ' A' ' 112' ' ' LEU . 6.9 ttpm? -73.45 -26.95 61.16 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.153 -0.476 . . . . 62.100000000000001 110.913 179.953 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' M' M ' 19' ' ' ILE . . . . . 0.447 HG22 ' HE1' ' A' ' 145' ' ' MET . 27.6 mt -93.02 -23.45 5.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.25 -0.432 . . . . 64.299999999999997 111.169 179.848 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' M' M ' 20' ' ' ARG . . . . . . . . . . . . . 25.5 ttp85 -52.07 -38.35 56.86 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.193 -0.458 . . . . 74.109999999999999 110.846 179.972 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' M' M ' 21' ' ' LEU . . . . . . . . . . . . . 6.1 mt 58.95 176.65 0.07 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.231 -0.44 . . . . 74.310000000000002 110.951 -179.979 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' M' M ' 22' ' ' ARG . . . . . . . . . . . . . 16.7 ttt180 -175.94 64.91 0.23 Allowed Pre-proline 0 C--N 1.328 -0.329 0 CA-C-O 121.672 0.748 . . . . 64.140000000000001 110.9 179.942 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' M' M ' 23' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.74 -48.38 0.74 Allowed 'Trans proline' 0 C--N 1.342 0.187 0 C-N-CA 122.753 2.302 . . . . 75.540000000000006 112.314 -179.987 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' M' M ' 24' ' ' GLY . . . . . . . . . . . . . . . 59.73 96.36 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.748 -0.739 . . . . 72.409999999999997 112.449 -179.983 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' M' M ' 25' ' ' GLY . . . . . . . . . . . . . . . -157.39 -148.65 5.18 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.743 -0.741 . . . . 51.420000000000002 112.512 -179.948 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' M' M ' 26' ' ' LYS . . . . . . . . . . . . . 3.0 mtpm? -137.34 136.95 38.41 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.901 0.381 . . . . 74.420000000000002 110.908 179.981 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' M' M ' 27' ' ' LYS . . . . . . . . . . . . . 4.6 ttmm -156.91 -72.71 0.1 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.196 -0.456 . . . . 65.519999999999996 110.888 179.924 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' M' M ' 28' ' ' GLN . . . . . . . . . . . . . 2.4 mm100 -147.57 179.66 7.52 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.243 -0.435 . . . . 73.530000000000001 110.889 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' M' M ' 29' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -104.05 -177.34 3.34 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.191 -0.459 . . . . 64.329999999999998 110.907 -179.835 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' M' M ' 30' ' ' LYS . . . . . 0.427 ' O ' ' HE3' ' A' ' 51' ' ' MET . 0.5 OUTLIER -147.46 49.87 1.08 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.116 -0.493 . . . . 74.140000000000001 110.896 179.908 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' M' M ' 31' ' ' LEU . . . . . 0.622 HD13 ' HE2' ' A' ' 51' ' ' MET . 10.9 tp -147.95 -46.56 0.16 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.253 -0.431 . . . . 70.409999999999997 110.898 179.984 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' M' M ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.45 -32.83 8.31 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.169 -0.469 . . . . 64.430000000000007 110.919 179.866 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' M' M ' 33' ' ' HIS . . . . . . . . . . . . . 77.6 t60 -47.99 -47.17 33.23 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.226 -0.443 . . . . 72.409999999999997 110.846 179.919 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' M' M ' 34' ' ' ILE . . . . . 0.501 ' H ' HD12 ' M' ' 34' ' ' ILE . 3.6 mp -51.73 -38.75 22.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.169 -0.469 . . . . 71.430000000000007 111.137 179.967 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' M' M ' 35' ' ' VAL . . . . . . . . . . . . . 47.1 t -49.01 -39.63 12.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.203 -0.453 . . . . 74.200000000000003 111.138 179.826 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' M' M ' 36' ' ' TRP . . . . . . . . . . . . . 20.9 m0 -59.19 -40.21 85.03 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.197 -0.456 . . . . 73.310000000000002 110.923 179.972 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' M' M ' 37' ' ' ALA . . . . . 0.992 ' HB3' HD13 ' A' ' 39' ' ' LEU . . . -63.01 -18.77 63.68 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.231 -0.44 . . . . 51.409999999999997 111.09 179.912 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' M' M ' 38' ' ' SER . . . . . . . . . . . . . 5.0 m -64.92 -17.8 64.66 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.207 -0.451 . . . . 64.129999999999995 110.886 -179.803 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' M' M ' 39' ' ' ARG . . . . . . . . . . . . . 52.3 mtp180 -52.12 -29.2 20.77 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.123 -0.49 . . . . 70.040000000000006 110.88 -179.931 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' M' M ' 40' ' ' GLU . . . . . . . . . . . . . 17.7 tp10 -90.05 -48.08 7.42 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.205 -0.452 . . . . 71.299999999999997 110.887 -179.955 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' M' M ' 41' ' ' LEU . . . . . 0.632 HD21 ' OG ' ' A' ' 38' ' ' SER . 6.8 mt -56.56 132.36 51.38 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.132 -0.485 . . . . 74.299999999999997 110.9 -179.958 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' M' M ' 42' ' ' GLU . . . . . . . . . . . . . 69.3 mt-10 -134.6 60.43 1.7 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.224 -0.444 . . . . 75.030000000000001 110.909 179.864 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' M' M ' 43' ' ' ARG . . . . . . . . . . . . . 26.8 mmt85 . . . . . 0 C--N 1.329 -0.319 0 CA-C-N 116.171 -0.468 . . . . 75.430000000000007 110.868 -179.917 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 241' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 262' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 301' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 322' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.457 -0.107 0 CA-C-O 120.793 0.33 . . . . 61.109999999999999 111.09 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -161.36 178.34 9.28 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.207 -0.451 . . . . 74.340000000000003 110.876 179.923 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 2.5 tp-100 58.29 94.05 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.181 -0.463 . . . . 75.219999999999999 110.906 -179.889 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -65.35 109.38 2.25 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.163 -0.471 . . . . 73.420000000000002 110.936 -180.0 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 77.6 p -94.11 175.86 6.54 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.201 -0.454 . . . . 71.129999999999995 111.166 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 22.8 tt0 -60.28 -38.69 84.35 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.209 -0.451 . . . . 62.119999999999997 110.875 -179.975 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 28.0 tt0 -68.51 -33.27 73.85 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.129 -0.487 . . . . 72.5 110.842 -179.89 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 32.4 tt0 -78.03 -41.2 36.48 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.161 -0.472 . . . . 74.030000000000001 110.921 -179.904 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 54.3 mt -72.69 -45.8 56.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.184 -0.462 . . . . 73.239999999999995 111.105 179.962 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -52.0 -29.54 21.26 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.23 -0.441 . . . . 74.040000000000006 111.087 179.818 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 41.3 tp10 -73.87 -38.39 64.45 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.263 -0.426 . . . . 72.409999999999997 110.93 -179.958 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 30.3 m-85 -75.82 -46.02 32.76 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.108 -0.496 . . . . 73.140000000000001 110.854 -179.933 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 35.1 ttmt -60.63 -35.47 76.26 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.175 -0.466 . . . . 72.310000000000002 110.955 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 23.0 mt-10 -58.62 -37.73 76.51 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.228 -0.442 . . . . 75.400000000000006 110.911 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.418 ' HB1' HG13 ' M' ' 35' ' ' VAL . . . -71.43 -43.94 65.79 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.126 -0.488 . . . . 70.430000000000007 111.096 179.913 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 92.6 t80 -55.49 -53.97 49.76 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.254 -0.43 . . . . 72.5 110.868 -179.912 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 12.6 t -52.43 -30.41 29.34 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.177 -0.465 . . . . 72.409999999999997 110.887 -179.799 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.627 HD23 ' HB3' ' M' ' 38' ' ' SER . 15.6 tp -65.71 -42.19 91.43 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.099 -0.5 . . . . 54.450000000000003 110.878 -179.968 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 43.1 m-85 -75.43 -25.46 57.51 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.181 -0.463 . . . . 70.0 110.866 179.948 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 20.9 t0 -84.02 98.54 9.89 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.167 -0.469 . . . . 64.140000000000001 110.85 179.994 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 15.7 ttmm -71.11 -55.51 8.04 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.167 -0.47 . . . . 71.010000000000005 110.906 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 22.5 p-10 -72.19 -10.15 59.4 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.225 -0.443 . . . . 74.120000000000005 110.833 179.909 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 51.82 42.14 52.53 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.777 -0.725 . . . . 74.510000000000005 112.506 -179.9 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 27.5 p-10 -88.44 -15.8 34.48 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.824 0.345 . . . . 73.340000000000003 110.814 -179.967 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 104.98 -7.14 44.17 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.776 -0.726 . . . . 72.5 112.496 -179.907 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 2.8 p -131.79 130.83 42.34 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.737 0.304 . . . . 75.230000000000004 111.168 -179.862 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.58 HG21 HD23 ' A' ' 32' ' ' LEU . 28.7 mt -93.69 120.32 42.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.191 -0.459 . . . . 72.200000000000003 111.143 179.91 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.601 HG22 ' CG2' ' A' ' 62' ' ' THR . 20.3 p -101.43 175.46 5.56 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.164 -0.471 . . . . 72.019999999999996 111.146 179.948 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 33.7 p -62.36 -24.97 67.66 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.185 -0.461 . . . . 74.400000000000006 111.146 -179.97 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 31.3 mttm -73.09 -50.1 24.78 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.215 -0.448 . . . . 72.549999999999997 110.898 179.901 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.554 ' O ' HG23 ' A' ' 35' ' ' VAL . 46.2 mt-10 -73.74 -32.69 63.98 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.255 -0.43 . . . . 74.530000000000001 110.883 179.975 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.581 ' O ' HD13 ' A' ' 32' ' ' LEU . 0.9 OUTLIER -73.51 -40.87 63.71 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.16 -0.473 . . . . 72.150000000000006 110.919 179.99 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -71.73 -40.52 58.3 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.736 -0.745 . . . . 64.25 112.51 179.923 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 96.7 m -59.6 -56.09 26.24 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.825 0.345 . . . . 75.120000000000005 111.107 -179.852 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.554 HG23 ' O ' ' A' ' 31' ' ' GLU . 97.4 t -51.44 -50.11 29.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.247 -0.433 . . . . 72.519999999999996 111.139 179.908 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 3.0 mtp -52.07 -32.1 33.22 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.125 -0.489 . . . . 74.299999999999997 110.901 179.918 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 40.8 ttt-85 -64.4 -48.23 76.19 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.207 -0.451 . . . . 63.530000000000001 110.868 -179.919 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . 0.688 ' OG ' HD11 ' M' ' 41' ' ' LEU . 2.2 p -59.42 -28.81 67.27 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.176 -0.466 . . . . 15.35 110.834 -179.775 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 1.029 HD13 ' HB3' ' M' ' 37' ' ' ALA . 32.8 mt -80.32 -16.27 54.98 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.183 -0.462 . . . . 73.239999999999995 110.928 179.994 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 101.58 27.11 7.31 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.721 -0.752 . . . . 62.43 112.487 179.927 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 5.2 mt-30 -119.69 135.42 54.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.802 0.334 . . . . 62.5 110.894 -179.845 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 32.5 t-20 -109.79 76.76 0.97 Allowed Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 121.627 0.727 . . . . 63.32 110.914 -179.949 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.75 149.73 67.35 Favored 'Trans proline' 0 C--O 1.232 0.191 0 C-N-CA 122.634 2.223 . . . . 63.409999999999997 112.375 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 20.9 p -99.15 176.77 5.43 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.23 -0.441 . . . . 74.540000000000006 111.109 -179.925 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 36.1 mm-40 -64.83 -47.02 79.47 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.185 -0.461 . . . . 74.439999999999998 110.949 179.94 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.4 -38.94 65.43 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.158 -0.474 . . . . 71.430000000000007 111.047 179.94 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 13.2 tt0 -55.8 -52.65 63.24 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.267 -0.424 . . . . 75.019999999999996 110.896 -179.916 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.457 ' CD2' HD12 ' A' ' 32' ' ' LEU . 9.2 mt -57.59 -52.19 66.43 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.15 -0.477 . . . . 63.539999999999999 110.948 179.985 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.2 mm-40 -56.97 -28.5 62.36 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.21 -0.45 . . . . 72.120000000000005 110.88 179.933 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -63.98 -49.57 71.97 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.199 -0.455 . . . . 63.009999999999998 110.881 179.998 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . 0.64 ' SD ' HD13 ' M' ' 31' ' ' LEU . 6.7 ptp -75.71 -37.49 59.4 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.233 -0.439 . . . . 74.409999999999997 110.878 179.985 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 79.2 mt -65.31 -47.49 86.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.23 -0.441 . . . . 72.439999999999998 111.138 179.984 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 85.2 m-20 -58.39 -33.58 69.78 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.147 -0.479 . . . . 73.340000000000003 110.895 179.921 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 15.0 mm-40 -62.41 -51.02 69.2 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.178 -0.464 . . . . 73.129999999999995 110.901 -179.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.401 HG13 ' CE1' ' M' ' 29' ' ' TYR . 17.6 m -77.98 -15.0 14.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.125 -0.489 . . . . 62.240000000000002 111.143 179.97 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 39.1 t0 -66.75 95.19 0.34 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.172 -0.467 . . . . 64.530000000000001 110.89 179.877 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.26 -35.3 17.36 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.166 -0.47 . . . . 73.430000000000007 111.101 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -88.22 -0.13 56.76 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.199 -0.455 . . . . 70.010000000000005 110.852 -179.998 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 52.79 58.95 9.99 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.726 -0.749 . . . . 35.25 112.495 -179.954 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 51.8 p-10 -114.63 -15.78 11.92 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.836 0.351 . . . . 64.150000000000006 110.888 -179.899 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 93.25 18.54 38.91 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.755 -0.736 . . . . 74.299999999999997 112.471 179.961 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . 0.601 ' CG2' HG22 ' A' ' 28' ' ' THR . 63.9 p -150.76 170.77 18.44 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.754 0.312 . . . . 73.430000000000007 111.153 -179.855 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 21.5 mt -102.47 109.53 26.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.257 -0.429 . . . . 74.310000000000002 111.132 179.942 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -74.13 -172.86 1.48 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.18 -0.464 . . . . 73.299999999999997 110.869 179.866 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.54 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 2.5 t80 -65.38 -58.05 13.16 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.647 0.737 . . . . 73.25 110.908 -179.923 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . 0.54 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 53.2 Cg_endo -69.75 -25.92 28.14 Favored 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.725 2.283 . . . . 65.439999999999998 112.317 -179.97 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -63.23 -39.98 96.17 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.211 -0.45 . . . . 74.150000000000006 110.879 -179.956 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 44.9 t80 -74.5 -35.94 63.23 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.132 -0.485 . . . . 74.420000000000002 110.883 -179.909 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 21.9 tp -71.03 -54.14 12.24 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.183 -0.462 . . . . 72.420000000000002 110.879 -179.978 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 13.4 t -51.69 -30.01 20.45 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.202 -0.453 . . . . 61.030000000000001 111.168 179.904 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 37.7 ttp -59.72 -41.95 91.99 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.205 -0.452 . . . . 64.519999999999996 110.842 179.975 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 3.5 mtt -79.84 -28.87 40.03 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.228 -0.442 . . . . 73.329999999999998 110.865 179.952 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -74.85 -28.48 60.69 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.273 -0.421 . . . . 63.530000000000001 111.111 179.908 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 50.5 ttm-85 -66.19 -19.15 65.74 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.215 -0.448 . . . . 64.239999999999995 110.906 -179.919 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 15.8 pttp -51.45 -30.62 20.23 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.15 -0.477 . . . . 72.129999999999995 110.87 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 18.9 mtt -84.16 -32.58 24.55 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.26 -0.427 . . . . 70.409999999999997 110.898 179.869 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 31.0 tttt -68.79 174.42 4.37 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.233 -0.44 . . . . 72.420000000000002 110.903 179.937 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -111.51 77.14 1.02 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.176 -0.465 . . . . 74.040000000000006 110.87 179.849 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 7.7 p -154.43 33.35 0.42 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.187 -0.46 . . . . 73.329999999999998 111.149 -179.888 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -116.18 -25.93 7.41 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.21 -0.45 . . . . 71.310000000000002 110.851 179.946 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . 0.554 ' O ' HD12 ' A' ' 85' ' ' ILE . 50.3 m -52.16 -44.25 64.49 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.189 -0.46 . . . . 65.409999999999997 110.841 -179.744 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 8.7 tm-20 -54.3 -27.51 35.99 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.139 -0.482 . . . . 73.329999999999998 110.88 -179.934 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 12.8 tp10 -67.64 -39.21 84.64 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.146 -0.479 . . . . 73.140000000000001 110.899 -179.941 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -58.01 -37.23 73.93 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.174 -0.466 . . . . 72.519999999999996 110.862 -179.911 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.596 HG21 HG22 ' A' ' 142' ' ' VAL . 5.0 mp -75.12 -50.04 26.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.154 -0.476 . . . . 73.310000000000002 111.117 -179.996 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 20.4 ttt-85 -61.68 -28.23 69.25 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.188 -0.46 . . . . 65.409999999999997 110.865 -179.992 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.672 ' O ' HG23 ' A' ' 91' ' ' VAL . 7.9 mm-40 -68.19 -48.33 65.54 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.193 -0.458 . . . . 75.319999999999993 110.932 -179.997 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . 0.75 ' HB1' ' CE2' ' A' ' 92' ' ' PHE . . . -74.04 -35.34 64.31 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.149 -0.478 . . . . 70.25 111.069 179.96 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 4.4 t80 -53.71 -47.78 70.2 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.256 -0.429 . . . . 75.129999999999995 110.863 -179.897 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 7.5 ptm180 -69.04 -25.95 64.73 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.131 -0.486 . . . . 73.430000000000007 110.875 -179.926 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . 0.672 HG23 ' O ' ' A' ' 87' ' ' GLU . 96.5 t -78.12 -27.4 14.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.194 -0.457 . . . . 74.5 111.131 179.988 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.75 ' CE2' ' HB1' ' A' ' 88' ' ' ALA . 21.9 m-85 -94.66 -26.14 16.45 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.134 -0.485 . . . . 72.510000000000005 110.888 -179.992 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 32.7 t0 -73.98 95.1 2.44 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.161 -0.472 . . . . 72.140000000000001 110.866 179.982 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 42.9 mmtt -78.68 -52.54 8.27 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.199 -0.455 . . . . 63.25 110.886 -180.0 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 52.1 p-10 -72.44 -9.15 58.17 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.211 -0.449 . . . . 64.450000000000003 110.838 179.917 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 59.79 28.37 65.59 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.709 -0.758 . . . . 73.299999999999997 112.487 -179.934 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 35.4 p-10 -81.77 -16.14 51.98 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.857 0.36 . . . . 50.229999999999997 110.881 -179.897 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 88.73 18.68 54.11 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.717 -0.754 . . . . 73.450000000000003 112.543 -179.952 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 23.6 m-85 -142.83 153.64 43.4 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.898 0.38 . . . . 72.129999999999995 110.918 -179.824 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.488 HD12 ' HD2' ' A' ' 141' ' ' PHE . 78.1 mt -119.25 127.04 75.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.089 -0.505 . . . . 72.219999999999999 111.133 179.954 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 6.4 p -112.44 -176.19 2.86 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.184 -0.462 . . . . 40.219999999999999 110.882 -179.946 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . 0.55 ' HB2' HG13 ' A' ' 125' ' ' ILE . . . -74.31 -27.49 60.73 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.149 -0.478 . . . . 72.340000000000003 111.144 179.9 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -72.01 -47.68 50.1 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.21 -0.45 . . . . 71.340000000000003 111.09 179.951 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -67.78 -46.07 73.02 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.209 -0.45 . . . . 70.409999999999997 110.897 -179.922 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.65 HD21 ' HE2' ' A' ' 124' ' ' MET . 21.2 tp -52.87 -39.56 62.74 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.109 -0.496 . . . . 75.530000000000001 110.936 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . 0.443 ' O ' HG23 ' A' ' 110' ' ' THR . 63.0 ttp85 -55.46 -38.7 69.41 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.177 -0.465 . . . . 74.319999999999993 110.874 179.939 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 40.8 t60 -66.83 -34.37 77.67 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.171 -0.468 . . . . 72.150000000000006 110.862 -179.989 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 88.6 t -72.0 -51.18 32.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.21 -0.45 . . . . 74.200000000000003 111.132 179.955 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 1.3 mmt -60.61 -43.72 97.12 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.184 -0.462 . . . . 75.239999999999995 110.869 179.929 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . 0.443 HG23 ' O ' ' A' ' 106' ' ' ARG . 9.7 p -54.03 -27.26 31.02 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.235 -0.439 . . . . 74.25 111.137 -179.929 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.9 t30 -70.78 -31.68 68.54 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.223 -0.444 . . . . 62.329999999999998 110.885 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.608 HD13 ' HE2' ' M' ' 18' ' ' LYS . 8.2 mt -71.19 -26.21 62.86 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.201 -0.454 . . . . 60.020000000000003 110.89 179.967 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 100.89 32.62 5.29 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.752 -0.737 . . . . 71.299999999999997 112.5 179.902 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 13.8 mm-40 -113.78 119.98 39.2 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.908 0.385 . . . . 73.099999999999994 110.896 -179.88 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . 0.466 ' O ' HD23 ' A' ' 116' ' ' LEU . 7.7 tptm -68.89 97.95 0.89 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.125 -0.488 . . . . 72.319999999999993 110.902 179.973 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.59 HD22 ' HG2' ' A' ' 120' ' ' GLU . 16.4 mt -133.01 119.41 20.03 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.244 -0.434 . . . . 73.219999999999999 110.896 179.929 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . 0.415 ' O ' HG23 ' A' ' 121' ' ' VAL . 82.2 p -84.22 174.31 10.3 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.183 -0.462 . . . . 62.32 111.126 179.966 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -52.68 -42.93 65.22 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.23 -0.441 . . . . 70.510000000000005 110.884 179.881 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -62.29 -33.39 74.56 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.194 -0.457 . . . . 63.340000000000003 110.862 -179.882 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . 0.59 ' HG2' HD22 ' A' ' 116' ' ' LEU . 6.2 tp10 -70.84 -39.42 72.97 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.151 -0.477 . . . . 74.010000000000005 110.867 -179.91 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.474 HG11 ' O ' ' A' ' 102' ' ' ALA . 21.9 t -65.25 -31.27 53.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.173 -0.467 . . . . 74.239999999999995 111.143 179.958 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 20.0 t0 -51.95 -46.11 64.62 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.133 -0.485 . . . . 73.430000000000007 110.905 179.919 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . 0.469 ' HG2' HD23 ' M' ' 13' ' ' LEU . 13.3 tp10 -56.57 -29.6 62.21 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.198 -0.455 . . . . 73.400000000000006 110.878 -179.947 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . 0.65 ' HE2' HD21 ' A' ' 105' ' ' LEU . 55.7 mtp -75.42 -59.51 2.72 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.171 -0.468 . . . . 73.319999999999993 110.913 179.957 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.55 HG13 ' HB2' ' A' ' 102' ' ' ALA . 35.9 mm -53.95 -35.69 28.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.216 -0.447 . . . . 75.109999999999999 111.119 179.948 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 1.6 tmt_? -63.33 -31.9 73.17 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.137 -0.483 . . . . 75.420000000000002 110.904 179.939 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -74.8 -52.39 11.58 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.203 -0.453 . . . . 64.25 110.887 -179.947 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.652 ' HB3' HG22 ' A' ' 136' ' ' VAL . . . -65.13 -34.44 78.4 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.19 -0.459 . . . . 62.310000000000002 111.081 179.957 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 49.3 t0 -68.38 86.73 0.29 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.247 -0.433 . . . . 74.049999999999997 110.853 179.981 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 61.1 mt -79.86 -46.21 22.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.228 -0.442 . . . . 73.450000000000003 111.17 179.982 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 21.2 p30 -72.8 -8.67 56.6 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.173 -0.467 . . . . 73.530000000000001 110.862 179.815 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 62.81 43.05 99.52 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.751 -0.737 . . . . 63.109999999999999 112.488 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 34.5 p-10 -88.3 -15.93 34.43 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.847 0.356 . . . . 71.329999999999998 110.907 -179.991 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 103.91 2.45 45.81 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.701 -0.761 . . . . 42.25 112.491 -179.957 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 4.1 tt0 -149.19 172.26 15.11 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.816 0.341 . . . . 72.439999999999998 110.894 -179.862 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 136' ' ' VAL . . . . . 0.652 HG22 ' HB3' ' A' ' 128' ' ' ALA . 86.5 t -107.84 111.91 37.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.192 -0.458 . . . . 71.109999999999999 111.135 179.939 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 43.6 p-10 -92.52 166.61 12.43 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.183 -0.462 . . . . 65.430000000000007 110.908 179.97 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . 0.511 ' O ' HG23 ' A' ' 142' ' ' VAL . 52.1 t80 -51.98 -46.79 64.98 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.169 -0.469 . . . . 74.439999999999998 110.949 -179.948 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -52.01 -43.77 63.82 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.116 -0.493 . . . . 75.530000000000001 110.847 -179.947 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 24.1 mt-10 -75.11 -31.86 61.24 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.204 -0.453 . . . . 62.509999999999998 110.877 -179.911 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . 0.589 ' CD1' HG23 ' A' ' 85' ' ' ILE . 6.2 t80 -68.07 -35.35 78.06 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.114 -0.494 . . . . 75.409999999999997 110.902 -179.895 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . 0.596 HG22 HG21 ' A' ' 85' ' ' ILE . 92.7 t -71.23 -42.14 74.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.161 -0.472 . . . . 75.0 111.15 179.932 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 18.4 tt0 -71.07 -28.55 64.43 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.156 -0.475 . . . . 62.549999999999997 110.89 -179.993 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 6.2 tpt -74.0 -55.24 6.38 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.211 -0.449 . . . . 75.010000000000005 110.911 179.927 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 11.9 ttm -66.09 -33.87 76.77 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.219 -0.446 . . . . 75.310000000000002 110.912 179.927 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 2.0 m -99.4 21.31 12.27 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.235 -0.439 . . . . 61.109999999999999 111.177 -179.961 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -51.94 126.34 17.99 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.143 -0.48 . . . . 71.030000000000001 111.081 179.88 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.286 0 CA-C-N 116.202 -0.454 . . . . 71.030000000000001 110.883 179.971 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' M' M ' 8' ' ' LEU . . . . . . . . . . . . . 4.5 mm? . . . . . 0 C--O 1.232 0.15 0 CA-C-O 120.839 0.352 . . . . 73.140000000000001 110.895 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' M' M ' 9' ' ' SER . . . . . . . . . . . . . 7.9 t 61.32 175.98 0.11 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.195 -0.457 . . . . 71.099999999999994 110.837 -179.952 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' M' M ' 10' ' ' GLY . . . . . . . . . . . . . . . 148.62 -36.97 1.06 Allowed Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.759 -0.734 . . . . 70.450000000000003 112.46 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' M' M ' 11' ' ' GLY . . . . . . . . . . . . . . . -101.94 48.64 1.07 Allowed Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.752 -0.737 . . . . 74.510000000000005 112.499 -179.907 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' M' M ' 12' ' ' GLU . . . . . . . . . . . . . 81.3 mm-40 -149.05 -174.36 4.62 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.928 0.394 . . . . 75.230000000000004 110.898 -179.849 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' M' M ' 13' ' ' LEU . . . . . 0.469 HD23 ' HG2' ' A' ' 123' ' ' GLU . 0.9 OUTLIER -87.64 75.8 8.98 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.18 -0.464 . . . . 73.099999999999994 110.897 -179.974 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' M' M ' 14' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -102.35 25.22 9.22 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.193 -0.458 . . . . 64.319999999999993 110.887 179.811 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' M' M ' 15' ' ' LYS . . . . . . . . . . . . . 7.4 mtmp? -75.36 -44.42 45.2 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.146 -0.479 . . . . 71.299999999999997 110.881 -179.998 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' M' M ' 16' ' ' TRP . . . . . 0.5 ' CE3' HD12 ' M' ' 19' ' ' ILE . 19.2 m95 -51.99 -38.95 58.53 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.184 -0.462 . . . . 71.530000000000001 110.978 179.917 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' M' M ' 17' ' ' GLU . . . . . . . . . . . . . 30.9 tp10 -56.17 -32.21 64.12 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.205 -0.452 . . . . 75.140000000000001 110.833 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' M' M ' 18' ' ' LYS . . . . . 0.608 ' HE2' HD13 ' A' ' 112' ' ' LEU . 6.4 ttpm? -63.36 -29.22 70.56 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.178 -0.464 . . . . 74.540000000000006 110.923 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' M' M ' 19' ' ' ILE . . . . . 0.5 HD12 ' CE3' ' M' ' 16' ' ' TRP . 28.8 mt -86.48 -25.13 6.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.192 -0.458 . . . . 53.509999999999998 111.166 179.86 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' M' M ' 20' ' ' ARG . . . . . . . . . . . . . 22.6 ttp180 -68.73 -26.4 65.24 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.17 -0.468 . . . . 75.150000000000006 110.863 179.984 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' M' M ' 21' ' ' LEU . . . . . . . . . . . . . 6.9 mt 63.03 -171.68 0.17 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.186 -0.461 . . . . 51.210000000000001 110.912 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' M' M ' 22' ' ' ARG . . . . . . . . . . . . . 27.9 mtm180 -63.18 148.73 92.46 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.557 0.694 . . . . 73.400000000000006 110.924 179.936 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' M' M ' 23' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.69 140.72 43.65 Favored 'Trans proline' 0 C--N 1.341 0.138 0 C-N-CA 122.665 2.244 . . . . 75.120000000000005 112.375 179.978 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' M' M ' 24' ' ' GLY . . . . . . . . . . . . . . . -171.61 -126.15 0.87 Allowed Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.754 -0.736 . . . . 35.420000000000002 112.504 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' M' M ' 25' ' ' GLY . . . . . . . . . . . . . . . 76.95 90.88 0.26 Allowed Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.746 -0.74 . . . . 42.439999999999998 112.45 -179.923 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' M' M ' 26' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -173.99 -38.27 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.839 0.352 . . . . 74.030000000000001 110.861 -179.99 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' M' M ' 27' ' ' LYS . . . . . . . . . . . . . 79.3 tttt -140.41 80.55 1.76 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.231 -0.44 . . . . 64.540000000000006 110.879 179.925 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' M' M ' 28' ' ' GLN . . . . . . . . . . . . . 21.4 mt-30 -143.37 98.0 3.18 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.197 -0.456 . . . . 72.310000000000002 110.948 179.962 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' M' M ' 29' ' ' TYR . . . . . 0.401 ' CE1' HG13 ' A' ' 55' ' ' VAL . 0.2 OUTLIER -115.77 -22.37 9.17 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.204 -0.453 . . . . 75.319999999999993 110.972 -179.878 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' M' M ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 63.35 22.1 13.12 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.089 -0.505 . . . . 74.510000000000005 110.889 179.878 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' M' M ' 31' ' ' LEU . . . . . 0.64 HD13 ' SD ' ' A' ' 51' ' ' MET . 13.7 tp -137.25 -51.39 0.65 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.196 -0.456 . . . . 53.210000000000001 110.911 179.924 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' M' M ' 32' ' ' LYS . . . . . . . . . . . . . 3.0 ptpp? -49.55 -39.14 33.74 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.219 -0.446 . . . . 72.540000000000006 110.901 179.81 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' M' M ' 33' ' ' HIS . . . . . . . . . . . . . 10.7 t-160 -50.09 -41.26 47.92 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.227 -0.442 . . . . 73.129999999999995 110.861 179.925 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' M' M ' 34' ' ' ILE . . . . . 0.444 HD12 HD12 ' M' ' 31' ' ' LEU . 65.0 mt -50.37 -39.32 16.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.19 -0.459 . . . . 63.32 111.148 179.989 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' M' M ' 35' ' ' VAL . . . . . 0.418 HG13 ' HB1' ' A' ' 15' ' ' ALA . 61.5 t -49.16 -40.28 13.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.192 -0.458 . . . . 73.549999999999997 111.121 179.824 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' M' M ' 36' ' ' TRP . . . . . . . . . . . . . 21.7 m0 -58.93 -39.52 81.83 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.122 -0.49 . . . . 74.420000000000002 110.927 179.985 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' M' M ' 37' ' ' ALA . . . . . 1.029 ' HB3' HD13 ' A' ' 39' ' ' LEU . . . -64.13 -18.61 64.59 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.218 -0.446 . . . . 34.210000000000001 111.117 179.869 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' M' M ' 38' ' ' SER . . . . . 0.627 ' HB3' HD23 ' A' ' 18' ' ' LEU . 0.8 OUTLIER -72.18 -17.98 61.9 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.237 -0.438 . . . . 74.150000000000006 110.872 -179.8 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' M' M ' 39' ' ' ARG . . . . . . . . . . . . . 4.6 tpt85 -60.75 -25.47 66.51 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.116 -0.493 . . . . 62.420000000000002 110.896 -179.914 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' M' M ' 40' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 -78.04 -47.99 17.12 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.131 -0.486 . . . . 62.210000000000001 110.874 -179.9 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' M' M ' 41' ' ' LEU . . . . . 0.688 HD11 ' OG ' ' A' ' 38' ' ' SER . 17.3 mt -52.98 119.94 5.25 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.163 -0.471 . . . . 73.120000000000005 110.93 179.98 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' M' M ' 42' ' ' GLU . . . . . . . . . . . . . 14.0 mt-10 71.63 -69.47 0.18 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.149 -0.478 . . . . 74.209999999999994 110.891 179.915 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' M' M ' 43' ' ' ARG . . . . . . . . . . . . . 57.8 ttt180 . . . . . 0 C--N 1.329 -0.294 0 CA-C-N 116.161 -0.472 . . . . 73.239999999999995 110.851 -179.924 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 241' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 262' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 301' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 322' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.801 0.334 . . . . 73.010000000000005 111.099 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -122.39 -42.54 2.34 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.23 -0.441 . . . . 62.420000000000002 110.869 179.981 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 45.3 tt0 -115.03 110.41 19.55 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.192 -0.458 . . . . 63.439999999999998 110.944 -179.934 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.427 HD22 ' CD ' ' A' ' 8' ' ' GLN . 12.2 mt -110.85 137.19 48.81 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.198 -0.455 . . . . 75.329999999999998 110.906 -179.968 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -113.72 177.44 4.63 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.227 -0.442 . . . . 74.329999999999998 111.099 179.948 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 16.9 tp10 -52.41 -30.19 28.04 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.178 -0.464 . . . . 61.409999999999997 110.869 -179.999 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -66.64 -41.45 88.25 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.171 -0.468 . . . . 75.209999999999994 110.876 -179.939 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . 0.427 ' CD ' HD22 ' A' ' 4' ' ' LEU . 19.4 tt0 -77.97 -40.06 40.5 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.162 -0.472 . . . . 72.310000000000002 110.936 -179.96 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 61.7 mt -68.78 -37.3 77.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.192 -0.458 . . . . 55.329999999999998 111.115 179.991 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -52.33 -49.85 63.45 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.166 -0.47 . . . . 55.210000000000001 111.082 179.852 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 17.0 mm-40 -54.92 -39.91 69.3 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.222 -0.445 . . . . 75.219999999999999 110.903 -179.916 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 31.4 m-85 -72.68 -41.2 65.59 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.148 -0.478 . . . . 72.209999999999994 110.852 -179.921 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 18.4 ttpp -54.81 -41.69 70.94 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.167 -0.47 . . . . 71.209999999999994 110.88 -179.99 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 8.4 tt0 -59.11 -36.12 74.63 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.228 -0.442 . . . . 70.439999999999998 110.884 179.948 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -67.91 -49.69 60.44 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.147 -0.478 . . . . 44.229999999999997 111.089 179.957 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 57.8 t80 -52.15 -49.52 63.59 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.226 -0.443 . . . . 74.140000000000001 110.913 -179.904 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 12.9 t -57.14 -30.39 64.39 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.151 -0.477 . . . . 63.130000000000003 110.893 -179.81 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.477 HD23 ' HB3' ' M' ' 38' ' ' SER . 15.7 tp -66.06 -42.2 89.78 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.068 -0.514 . . . . 74.140000000000001 110.885 179.984 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.613 ' HA ' HG21 ' A' ' 35' ' ' VAL . 67.6 m-85 -78.02 -24.92 47.72 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.222 -0.445 . . . . 74.310000000000002 110.866 179.94 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 14.3 t0 -79.14 98.61 6.63 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.178 -0.464 . . . . 75.430000000000007 110.866 179.975 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.448 ' NZ ' HG21 ' A' ' 34' ' ' THR . 9.2 ttmm -66.49 -50.28 63.79 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.201 -0.454 . . . . 63.32 110.895 179.995 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 18.5 p-10 -81.46 -10.09 59.57 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.219 -0.446 . . . . 71.030000000000001 110.831 179.908 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 52.04 55.64 20.38 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.73 -0.748 . . . . 24.039999999999999 112.508 -179.889 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 29.2 p-10 -111.56 17.74 19.73 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.798 0.332 . . . . 70.219999999999999 110.849 -179.968 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 71.68 18.25 77.17 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.753 -0.737 . . . . 43.109999999999999 112.529 -179.907 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 22.3 p -145.46 156.53 43.8 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.714 0.292 . . . . 73.510000000000005 111.155 -179.85 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.413 HG22 ' HB2' ' A' ' 32' ' ' LEU . 28.8 mt -130.27 125.47 59.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.233 -0.44 . . . . 74.030000000000001 111.193 179.924 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.6 HG22 HG21 ' A' ' 62' ' ' THR . 80.9 p -110.53 177.14 4.78 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.206 -0.452 . . . . 70.109999999999999 111.168 179.998 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 49.5 p -63.54 -25.47 68.26 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.22 -0.445 . . . . 74.430000000000007 111.115 -179.962 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 2.3 tppt? -79.96 -50.17 10.82 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.174 -0.466 . . . . 75.150000000000006 110.868 179.94 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 -67.89 -36.97 81.15 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.207 -0.451 . . . . 75.530000000000001 110.867 179.996 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.413 ' HB2' HG22 ' A' ' 27' ' ' ILE . 4.1 tt -73.83 -53.58 9.92 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.157 -0.474 . . . . 61.119999999999997 110.957 -179.973 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -51.92 -28.4 24.3 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.743 -0.741 . . . . 61.140000000000001 112.524 179.83 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.448 HG21 ' NZ ' ' A' ' 21' ' ' LYS . 97.6 m -63.18 -58.99 5.37 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.883 0.373 . . . . 64.219999999999999 111.172 -179.866 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.613 HG21 ' HA ' ' A' ' 19' ' ' PHE . 51.6 t -57.72 -34.57 48.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.173 -0.467 . . . . 72.310000000000002 111.141 179.891 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 6.3 mmm -59.62 -49.01 79.41 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.158 -0.474 . . . . 73.329999999999998 110.874 179.968 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 29.7 ttp180 -57.17 -42.65 81.52 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.236 -0.438 . . . . 75.420000000000002 110.872 -179.945 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . 0.419 ' OG ' HD21 ' M' ' 41' ' ' LEU . 1.6 t -57.91 -25.28 60.64 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.202 -0.454 . . . . 62.509999999999998 110.883 -179.814 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.891 HD13 ' HB3' ' M' ' 37' ' ' ALA . 83.3 mt -94.41 -10.39 32.64 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.084 -0.507 . . . . 70.439999999999998 110.876 -179.98 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 101.54 -6.63 55.4 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.76 -0.733 . . . . 44.32 112.468 179.93 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 15.8 tp60 -87.39 102.34 14.44 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.833 0.349 . . . . 75.099999999999994 110.9 -179.853 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 6.1 t-20 -109.85 76.75 0.98 Allowed Pre-proline 0 C--N 1.33 -0.279 0 CA-C-O 121.574 0.702 . . . . 65.340000000000003 110.887 -179.971 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.79 168.0 22.86 Favored 'Trans proline' 0 C--O 1.232 0.187 0 C-N-CA 122.709 2.273 . . . . 71.439999999999998 112.351 179.937 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 79.0 p -84.68 161.78 19.94 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.237 -0.438 . . . . 51.240000000000002 111.118 -179.949 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 94.1 mt-10 -52.41 -38.9 60.14 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.17 -0.468 . . . . 64.209999999999994 110.862 179.983 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.32 -39.28 65.39 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.183 -0.462 . . . . 42.530000000000001 111.051 179.957 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -62.09 -47.55 84.13 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.232 -0.44 . . . . 63.240000000000002 110.906 -179.923 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 22.0 mt -55.43 -47.48 75.91 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.159 -0.473 . . . . 71.310000000000002 110.894 -179.984 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 37.1 tp60 -71.86 -28.1 63.32 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.216 -0.447 . . . . 44.200000000000003 110.897 179.938 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -56.21 -49.77 73.14 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.218 -0.446 . . . . 63.329999999999998 110.888 179.904 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 6.0 ptp -69.85 -36.28 75.41 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.191 -0.459 . . . . 62.43 110.894 -179.986 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 87.3 mt -63.78 -41.35 92.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.249 -0.432 . . . . 73.310000000000002 111.153 179.922 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 34.5 m-20 -70.38 -31.7 69.05 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.18 -0.464 . . . . 73.230000000000004 110.907 179.935 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -71.62 -25.09 62.01 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.142 -0.481 . . . . 64.329999999999998 110.851 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.493 HG12 ' CE2' ' M' ' 29' ' ' TYR . 29.1 m -106.65 7.2 9.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.196 -0.456 . . . . 52.32 111.119 179.98 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -82.62 99.77 9.77 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.192 -0.458 . . . . 73.209999999999994 110.843 179.961 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.4 -33.85 17.76 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.148 -0.478 . . . . 72.200000000000003 111.147 179.932 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 2.6 p-10 -92.52 -0.57 57.32 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.199 -0.455 . . . . 75.230000000000004 110.869 179.945 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 50.85 60.94 6.5 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.744 -0.741 . . . . 72.109999999999999 112.517 -179.899 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 50.9 p-10 -114.55 -15.78 11.97 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.915 0.388 . . . . 61.240000000000002 110.901 -179.873 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 95.43 15.71 42.87 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.726 -0.75 . . . . 62.340000000000003 112.503 179.963 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . 0.6 HG21 HG22 ' A' ' 28' ' ' THR . 22.5 p -152.68 175.45 12.81 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.795 0.331 . . . . 71.239999999999995 111.157 -179.922 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.57 HG21 ' HD1' ' A' ' 68' ' ' PHE . 27.0 mt -106.83 111.57 36.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.213 -0.449 . . . . 71.319999999999993 111.13 179.912 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -77.93 -172.78 2.83 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.158 -0.474 . . . . 72.019999999999996 110.856 179.89 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.538 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 2.4 t80 -64.93 -57.94 14.38 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.604 0.716 . . . . 73.140000000000001 110.9 -179.895 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . 0.538 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 53.8 Cg_endo -69.78 -28.74 24.76 Favored 'Trans proline' 0 C--N 1.341 0.159 0 C-N-CA 122.677 2.251 . . . . 73.430000000000007 112.353 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 18.2 mt-10 -60.97 -39.73 90.72 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.188 -0.46 . . . . 72.150000000000006 110.875 -179.984 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . 0.57 ' HD1' HG21 ' A' ' 63' ' ' ILE . 20.1 t80 -74.3 -36.23 63.72 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.094 -0.503 . . . . 75.329999999999998 110.848 -179.864 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 27.7 tp -69.53 -53.82 17.15 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.191 -0.459 . . . . 74.530000000000001 110.913 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 14.7 t -53.08 -27.95 22.74 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.193 -0.458 . . . . 61.229999999999997 111.134 179.934 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . 0.488 ' SD ' HG11 ' A' ' 55' ' ' VAL . 42.6 ttp -64.4 -49.9 69.72 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.27 -0.423 . . . . 63.450000000000003 110.856 179.914 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . 0.414 ' HE3' HG11 ' M' ' 35' ' ' VAL . 1.2 mtt -53.33 -44.15 68.24 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.244 -0.435 . . . . 52.32 110.849 179.998 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -74.89 -33.26 62.02 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.229 -0.441 . . . . 61.329999999999998 111.109 179.933 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 20.1 tpp180 -62.28 -18.46 61.33 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.201 -0.454 . . . . 74.129999999999995 110.836 -179.887 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 13.8 pttp -50.81 -31.05 15.84 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.181 -0.463 . . . . 72.200000000000003 110.878 179.954 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 25.5 tpp -58.33 -36.18 73.01 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.254 -0.43 . . . . 63.43 110.866 179.903 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 5.7 tttp -68.79 -169.77 0.19 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.281 -0.418 . . . . 54.340000000000003 110.881 179.924 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . 0.442 ' O ' HG23 ' A' ' 79' ' ' THR . 16.5 t0 -73.06 130.8 41.13 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.202 -0.454 . . . . 71.219999999999999 110.87 179.875 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . 0.442 HG23 ' O ' ' A' ' 78' ' ' ASP . 1.7 p -157.17 23.24 0.31 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.182 -0.463 . . . . 60.409999999999997 111.12 -179.912 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -68.63 -13.47 62.38 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.259 -0.428 . . . . 72.319999999999993 110.863 179.904 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 8.1 t -51.79 -30.04 21.44 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.213 -0.448 . . . . 75.120000000000005 110.856 -179.755 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -89.58 -49.82 6.44 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.163 -0.472 . . . . 55.140000000000001 110.893 -179.993 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 45.9 tp10 -53.68 -41.91 67.39 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.204 -0.453 . . . . 74.329999999999998 110.897 -179.982 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -56.88 -28.27 61.59 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.162 -0.472 . . . . 75.310000000000002 110.87 -179.928 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.639 HG21 HG13 ' A' ' 142' ' ' VAL . 62.1 mt -74.88 -47.12 38.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.159 -0.473 . . . . 75.219999999999999 111.161 179.955 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 44.8 ttp85 -68.82 -52.25 32.07 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.164 -0.471 . . . . 73.439999999999998 110.845 179.977 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.733 ' O ' HG23 ' A' ' 91' ' ' VAL . 16.0 tp10 -54.54 -53.48 53.9 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.24 -0.436 . . . . 74.25 110.908 -179.937 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -53.36 -50.74 64.43 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.127 -0.488 . . . . 74.340000000000003 111.12 179.911 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 5.9 t80 -52.12 -51.28 58.84 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.22 -0.445 . . . . 74.329999999999998 110.899 -179.957 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 60.0 ttt-85 -59.93 -45.05 93.84 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.199 -0.455 . . . . 65.140000000000001 110.873 -179.93 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . 0.733 HG23 ' O ' ' A' ' 87' ' ' GLU . 91.6 t -53.94 -45.47 63.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.211 -0.45 . . . . 72.319999999999993 111.172 179.954 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 10.7 m-85 -76.39 -26.35 55.49 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.167 -0.47 . . . . 73.540000000000006 110.873 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 14.1 t0 -68.11 96.77 0.65 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.159 -0.473 . . . . 72.140000000000001 110.889 179.958 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 17.3 mmtt -75.16 -53.2 9.24 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.164 -0.471 . . . . 54.049999999999997 110.923 179.973 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 52.9 p30 -77.09 -9.07 58.49 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.215 -0.448 . . . . 73.349999999999994 110.808 179.919 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 59.6 26.51 62.42 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.74 -0.743 . . . . 71.5 112.459 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 37.8 p-10 -81.9 -16.12 51.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.878 0.37 . . . . 72.409999999999997 110.919 -179.905 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 90.08 18.76 49.21 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.773 -0.727 . . . . 42.409999999999997 112.483 179.927 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 15.0 m-85 -140.41 132.38 27.76 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.858 0.361 . . . . 72.129999999999995 110.917 -179.779 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 62.2 mt -101.2 135.04 39.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.138 -0.483 . . . . 70.5 111.151 179.902 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 89.5 p -117.1 -177.97 3.33 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.167 -0.469 . . . . 60.43 110.843 -179.881 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . 0.738 ' O ' HG11 ' A' ' 121' ' ' VAL . . . -70.32 -35.51 73.69 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.139 -0.482 . . . . 74.299999999999997 111.058 179.922 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -71.9 -35.28 69.66 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.246 -0.433 . . . . 43.240000000000002 111.104 179.931 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -76.88 -46.64 23.78 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.226 -0.443 . . . . 74.510000000000005 110.888 -179.909 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 19.0 tp -52.96 -48.01 67.72 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.175 -0.466 . . . . 72.430000000000007 110.893 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . 0.706 ' HB2' HG21 ' A' ' 121' ' ' VAL . 59.3 ttp85 -51.99 -40.04 60.31 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.199 -0.455 . . . . 64.420000000000002 110.858 179.975 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 13.5 t60 -55.85 -34.4 65.39 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.187 -0.46 . . . . 64.0 110.838 179.994 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 54.5 t -72.59 -52.03 25.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.235 -0.439 . . . . 75.209999999999994 111.122 -179.993 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . 0.479 ' HB3' HD12 ' A' ' 116' ' ' LEU . 10.3 mmt -53.99 -28.12 35.91 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.153 -0.476 . . . . 72.409999999999997 110.874 179.908 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 4.0 m -66.9 -37.09 83.73 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.198 -0.455 . . . . 64.120000000000005 111.159 -179.907 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 43.0 t-20 -73.48 -26.12 60.76 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.212 -0.449 . . . . 55.399999999999999 110.904 179.975 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -70.69 -25.89 63.18 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.165 -0.47 . . . . 72.209999999999994 110.934 179.96 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 100.97 19.85 15.89 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.757 -0.735 . . . . 53.219999999999999 112.5 179.873 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -111.34 115.68 29.71 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.931 0.396 . . . . 74.0 110.892 -179.896 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . 0.584 ' O ' HD23 ' A' ' 116' ' ' LEU . 40.3 pttt -70.65 121.53 18.08 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.123 -0.489 . . . . 71.200000000000003 110.935 179.923 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.628 HD22 ' HG2' ' A' ' 120' ' ' GLU . 11.3 mt -143.33 161.0 39.49 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.235 -0.439 . . . . 63.329999999999998 110.935 179.947 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 67.9 p -118.59 174.33 6.33 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.205 -0.452 . . . . 63.100000000000001 111.089 179.993 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 47.8 m-20 -52.04 -48.35 64.63 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.182 -0.463 . . . . 64.430000000000007 110.865 179.9 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -60.67 -33.44 72.83 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.166 -0.47 . . . . 73.319999999999993 110.945 -179.929 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . 0.628 ' HG2' HD22 ' A' ' 116' ' ' LEU . 1.1 tp10 -68.97 -44.81 72.17 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.133 -0.485 . . . . 71.140000000000001 110.904 -179.979 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.738 HG11 ' O ' ' A' ' 102' ' ' ALA . 63.3 t -58.04 -33.32 46.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.174 -0.466 . . . . 71.230000000000004 111.106 179.963 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -51.97 -43.76 63.7 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.229 -0.441 . . . . 43.43 110.863 179.934 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 22.9 tp10 -56.33 -31.52 63.8 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.202 -0.454 . . . . 74.430000000000007 110.916 -179.928 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . 0.403 ' HE3' ' HB3' ' M' ' 15' ' ' LYS . 80.0 mtp -76.03 -59.5 2.73 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.16 -0.473 . . . . 74.209999999999994 110.891 179.938 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 34.8 mm -53.99 -35.74 29.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.198 -0.455 . . . . 71.349999999999994 111.097 179.992 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 9.6 tpt180 -65.43 -31.76 73.02 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.187 -0.46 . . . . 75.129999999999995 110.842 179.991 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -71.97 -49.71 35.0 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.202 -0.454 . . . . 53.229999999999997 110.852 -179.908 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.563 ' HB3' HG22 ' A' ' 136' ' ' VAL . . . -70.39 -33.66 71.66 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.208 -0.451 . . . . 60.509999999999998 111.087 179.936 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 50.7 t0 -68.41 86.63 0.29 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.21 -0.45 . . . . 71.299999999999997 110.835 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . 0.437 HD11 HE21 ' A' ' 143' ' ' GLN . 59.1 mt -79.98 -45.33 22.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.18 -0.464 . . . . 73.200000000000003 111.148 179.962 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 23.1 p30 -72.69 -8.82 57.24 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.168 -0.469 . . . . 61.020000000000003 110.833 179.866 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 62.8 43.76 98.47 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.725 -0.75 . . . . 31.329999999999998 112.481 -179.925 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 32.5 p-10 -89.33 -16.05 31.99 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.868 0.365 . . . . 64.319999999999993 110.882 -179.961 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 102.66 3.37 49.74 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.724 -0.75 . . . . 63.340000000000003 112.478 -179.964 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 3.8 tt0 -149.26 172.22 15.23 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.816 0.341 . . . . 74.140000000000001 110.923 -179.87 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 136' ' ' VAL . . . . . 0.563 HG22 ' HB3' ' A' ' 128' ' ' ALA . 98.9 t -113.18 114.87 48.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.248 -0.433 . . . . 73.420000000000002 111.192 179.94 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 41.9 p-10 -93.28 167.87 11.46 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.174 -0.466 . . . . 74.109999999999999 110.928 -179.975 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . 0.652 ' O ' HG23 ' A' ' 142' ' ' VAL . 14.1 t80 -51.96 -43.65 63.61 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.218 -0.446 . . . . 72.519999999999996 110.971 -179.931 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -55.74 -55.14 35.79 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.148 -0.478 . . . . 52.109999999999999 110.881 179.96 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 88.8 mt-10 -62.08 -45.42 93.58 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.172 -0.467 . . . . 65.319999999999993 110.9 -179.941 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 69.4 t80 -54.88 -54.94 36.03 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.129 -0.487 . . . . 73.450000000000003 110.903 -179.914 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . 0.652 HG23 ' O ' ' A' ' 138' ' ' TYR . 96.8 t -53.86 -43.35 56.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.13 -0.486 . . . . 55.409999999999997 111.172 179.91 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . 0.437 HE21 HD11 ' A' ' 130' ' ' ILE . 1.1 tm0? -64.23 -58.42 6.62 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.155 -0.475 . . . . 71.25 110.934 179.978 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 11.3 tpt -57.5 -24.83 58.17 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.235 -0.439 . . . . 71.219999999999999 110.909 179.927 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 145' ' ' MET . . . . . 0.474 ' HE1' HG22 ' M' ' 19' ' ' ILE . 0.3 OUTLIER -86.75 -24.14 25.21 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.2 -0.455 . . . . 73.439999999999998 110.898 179.932 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 97.3 m -89.15 -24.85 22.1 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.234 -0.439 . . . . 71.010000000000005 111.119 -179.934 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -56.27 156.97 5.2 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.255 -0.43 . . . . 33.140000000000001 111.101 179.868 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 116.25 -0.432 . . . . 63.43 110.921 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' M' M ' 8' ' ' LEU . . . . . . . . . . . . . 5.2 mp . . . . . 0 C--O 1.232 0.137 0 CA-C-O 120.768 0.318 . . . . 65.310000000000002 110.913 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' M' M ' 9' ' ' SER . . . . . . . . . . . . . 1.3 m -131.73 169.79 15.7 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.243 -0.435 . . . . 75.340000000000003 110.901 -179.917 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' M' M ' 10' ' ' GLY . . . . . . . . . . . . . . . -129.2 150.44 18.86 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.719 -0.753 . . . . 53.420000000000002 112.454 -179.951 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' M' M ' 11' ' ' GLY . . . . . . . . . . . . . . . 153.81 -64.32 0.35 Allowed Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.777 -0.725 . . . . 72.409999999999997 112.52 -179.918 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' M' M ' 12' ' ' GLU . . . . . . . . . . . . . 5.7 pm0 -117.74 161.06 20.31 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.919 0.39 . . . . 74.109999999999999 110.847 -179.858 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' M' M ' 13' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -87.4 76.65 9.03 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.126 -0.488 . . . . 71.25 110.89 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' M' M ' 14' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -102.83 24.31 10.84 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.233 -0.44 . . . . 63.409999999999997 110.854 179.863 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' M' M ' 15' ' ' LYS . . . . . 0.403 ' HB3' ' HE3' ' A' ' 124' ' ' MET . 7.2 mttp -63.5 -57.25 10.81 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.232 -0.44 . . . . 72.450000000000003 110.895 179.986 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' M' M ' 16' ' ' TRP . . . . . . . . . . . . . 67.2 m95 -52.82 -41.46 64.23 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.216 -0.447 . . . . 74.510000000000005 110.893 179.909 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' M' M ' 17' ' ' GLU . . . . . . . . . . . . . 15.4 tm-20 -57.4 -30.2 64.74 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.241 -0.436 . . . . 71.530000000000001 110.893 -179.929 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' M' M ' 18' ' ' LYS . . . . . . . . . . . . . 15.5 tttp -62.91 -28.03 69.78 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.176 -0.465 . . . . 74.329999999999998 110.875 179.946 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' M' M ' 19' ' ' ILE . . . . . 0.474 HG22 ' HE1' ' A' ' 145' ' ' MET . 22.7 mt -98.66 -23.83 4.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.267 -0.424 . . . . 72.129999999999995 111.156 179.868 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' M' M ' 20' ' ' ARG . . . . . . . . . . . . . 30.6 ttt-85 -52.04 -30.18 24.48 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.185 -0.461 . . . . 75.409999999999997 110.836 -179.971 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' M' M ' 21' ' ' LEU . . . . . . . . . . . . . 4.8 mt 55.03 -175.02 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.216 -0.447 . . . . 52.420000000000002 110.889 179.982 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' M' M ' 22' ' ' ARG . . . . . . . . . . . . . 47.3 ttt180 -125.29 136.78 28.66 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.583 0.706 . . . . 73.219999999999999 110.861 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' M' M ' 23' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.78 128.44 16.01 Favored 'Trans proline' 0 C--N 1.341 0.157 0 C-N-CA 122.679 2.252 . . . . 75.549999999999997 112.346 179.957 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' M' M ' 24' ' ' GLY . . . . . . . . . . . . . . . -178.19 48.58 0.1 OUTLIER Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.727 -0.749 . . . . 53.009999999999998 112.458 179.973 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' M' M ' 25' ' ' GLY . . . . . . . . . . . . . . . -127.85 -133.48 3.75 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.768 -0.73 . . . . 51.299999999999997 112.525 -179.979 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' M' M ' 26' ' ' LYS . . . . . . . . . . . . . 22.6 ttpp -178.61 118.7 0.08 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.801 0.334 . . . . 63.210000000000001 110.879 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' M' M ' 27' ' ' LYS . . . . . . . . . . . . . 3.0 mmmp? -150.7 -76.54 0.14 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.242 -0.435 . . . . 72.439999999999998 110.867 179.839 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' M' M ' 28' ' ' GLN . . . . . . . . . . . . . 4.2 pt20 179.04 167.79 0.96 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.247 -0.433 . . . . 75.430000000000007 110.883 179.94 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' M' M ' 29' ' ' TYR . . . . . 0.493 ' CE2' HG12 ' A' ' 55' ' ' VAL . 3.5 m-85 -66.8 176.9 1.82 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.157 -0.474 . . . . 71.230000000000004 110.905 -179.831 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' M' M ' 30' ' ' LYS . . . . . . . . . . . . . 2.1 pttp -107.37 15.85 24.52 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.117 -0.492 . . . . 75.030000000000001 110.857 179.938 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' M' M ' 31' ' ' LEU . . . . . 0.593 ' HA ' HD12 ' M' ' 34' ' ' ILE . 7.2 tp -124.33 -48.78 1.82 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.228 -0.442 . . . . 71.25 110.918 179.935 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' M' M ' 32' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -47.21 -40.15 15.62 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.212 -0.449 . . . . 71.209999999999994 110.937 179.809 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' M' M ' 33' ' ' HIS . . . . . . . . . . . . . 79.9 t60 -48.12 -46.35 34.04 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.148 -0.478 . . . . 74.209999999999994 110.865 179.913 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' M' M ' 34' ' ' ILE . . . . . 0.593 HD12 ' HA ' ' M' ' 31' ' ' LEU . 3.3 mt -51.77 -38.57 22.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.214 -0.448 . . . . 72.239999999999995 111.096 179.996 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' M' M ' 35' ' ' VAL . . . . . 0.414 HG11 ' HE3' ' A' ' 72' ' ' MET . 48.5 t -50.1 -38.9 15.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.18 -0.464 . . . . 45.350000000000001 111.107 179.886 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' M' M ' 36' ' ' TRP . . . . . . . . . . . . . 26.6 m0 -59.29 -39.03 81.67 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.188 -0.46 . . . . 73.209999999999994 110.914 179.954 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' M' M ' 37' ' ' ALA . . . . . 0.891 ' HB3' HD13 ' A' ' 39' ' ' LEU . . . -63.94 -18.39 64.2 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.225 -0.443 . . . . 70.140000000000001 111.095 179.911 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' M' M ' 38' ' ' SER . . . . . 0.477 ' HB3' HD23 ' A' ' 18' ' ' LEU . 2.5 m -71.07 -17.94 62.58 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.243 -0.435 . . . . 50.340000000000003 110.857 -179.803 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' M' M ' 39' ' ' ARG . . . . . . . . . . . . . 14.9 mmm180 -52.07 -29.96 23.71 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.151 -0.477 . . . . 73.409999999999997 110.849 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' M' M ' 40' ' ' GLU . . . . . . . . . . . . . 9.4 tt0 -92.37 -40.71 10.74 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.21 -0.45 . . . . 64.439999999999998 110.915 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' M' M ' 41' ' ' LEU . . . . . 0.419 HD21 ' OG ' ' A' ' 38' ' ' SER . 5.0 mt -52.31 170.13 0.07 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.162 -0.472 . . . . 62.130000000000003 110.931 179.991 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' M' M ' 42' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -124.64 -50.21 1.74 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.176 -0.466 . . . . 61.229999999999997 110.883 179.944 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' M' M ' 43' ' ' ARG . . . . . . . . . . . . . 10.3 mmt85 . . . . . 0 C--N 1.329 -0.286 0 CA-C-N 116.158 -0.474 . . . . 60.439999999999998 110.872 -179.891 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 241' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 262' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 301' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 322' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.158 0 CA-C-O 120.775 0.321 . . . . 64.239999999999995 111.116 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -100.94 34.56 2.45 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.227 -0.442 . . . . 74.219999999999999 110.856 179.982 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 48.7 mt-30 -144.64 100.89 3.59 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.183 -0.462 . . . . 70.109999999999999 110.901 -179.913 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.77 HD22 ' HG2' ' A' ' 8' ' ' GLN . 68.3 mt -96.12 149.13 21.96 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.16 -0.473 . . . . 71.340000000000003 110.878 -179.928 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 7.5 p -120.67 174.48 6.55 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.211 -0.449 . . . . 42.43 111.13 179.936 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -52.92 -30.0 31.82 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.236 -0.438 . . . . 74.109999999999999 110.875 -180.0 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -65.9 -41.88 90.95 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.167 -0.47 . . . . 75.409999999999997 110.836 -179.89 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . 0.77 ' HG2' HD22 ' A' ' 4' ' ' LEU . 1.6 tp-100 -77.92 -41.46 36.34 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.163 -0.471 . . . . 72.140000000000001 110.904 -179.924 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 62.0 mt -67.04 -37.14 78.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.212 -0.449 . . . . 55.100000000000001 111.124 179.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -51.95 -49.9 62.27 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.191 -0.459 . . . . 63.539999999999999 111.098 179.815 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 25.3 mm-40 -54.87 -52.24 63.45 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.179 -0.464 . . . . 74.420000000000002 110.931 -179.966 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 66.0 m-85 -60.04 -44.17 94.83 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.123 -0.489 . . . . 73.430000000000007 110.933 -179.953 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 38.0 ttmt -51.98 -33.5 38.26 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.088 -0.505 . . . . 63.100000000000001 110.866 -179.996 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -68.74 -36.65 78.66 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.234 -0.439 . . . . 71.109999999999999 110.904 179.975 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -66.52 -52.28 47.52 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.14 -0.482 . . . . 40.020000000000003 111.076 179.931 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 42.4 t80 -52.6 -47.44 66.94 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.19 -0.459 . . . . 63.439999999999998 110.859 -179.898 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.6 m -59.48 -28.98 67.5 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.156 -0.475 . . . . 53.509999999999998 110.885 -179.793 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.65 HD23 ' HB3' ' M' ' 38' ' ' SER . 15.3 tp -68.59 -47.54 66.48 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.111 -0.495 . . . . 75.400000000000006 110.897 -179.995 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 62.1 m-85 -71.67 -26.09 62.39 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.178 -0.465 . . . . 61.020000000000003 110.89 179.928 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 18.6 t0 -86.33 98.47 10.99 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.154 -0.475 . . . . 71.420000000000002 110.845 -179.996 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 39.6 mtpt -71.86 -53.12 14.21 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.216 -0.447 . . . . 74.209999999999994 110.862 -179.977 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 26.3 p-10 -73.5 -10.11 59.39 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.244 -0.435 . . . . 73.439999999999998 110.802 179.912 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 52.03 46.45 55.88 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.792 -0.718 . . . . 52.450000000000003 112.451 -179.946 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 26.7 p-10 -88.46 -15.73 34.62 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.891 0.377 . . . . 71.5 110.906 179.993 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 105.32 -11.73 47.65 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.696 -0.764 . . . . 65.030000000000001 112.508 -179.902 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 51.6 p -131.31 130.71 43.09 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.755 0.312 . . . . 72.230000000000004 111.157 -179.886 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 29.8 mt -90.72 135.82 25.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.206 -0.452 . . . . 65.340000000000003 111.138 179.898 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.672 HG22 HG22 ' A' ' 62' ' ' THR . 15.0 p -115.97 -179.37 3.64 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.195 -0.457 . . . . 61.039999999999999 111.176 179.936 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.685 HG23 HD12 ' A' ' 52' ' ' ILE . 8.2 p -68.69 -33.02 73.25 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.227 -0.442 . . . . 73.25 111.167 -179.988 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 14.8 ptpt -69.6 -41.42 75.75 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.194 -0.457 . . . . 75.319999999999993 110.889 179.878 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.491 ' O ' HG23 ' A' ' 35' ' ' VAL . 62.1 mt-10 -75.9 -35.4 59.83 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.22 -0.445 . . . . 75.340000000000003 110.924 179.968 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.1 tt -74.31 -53.78 9.01 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.136 -0.484 . . . . 75.549999999999997 110.904 -179.962 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -52.1 -43.28 56.08 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.801 -0.714 . . . . 65.409999999999997 112.488 179.904 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 96.0 m -56.97 -55.07 39.45 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.816 0.341 . . . . 75.299999999999997 111.146 -179.896 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.491 HG23 ' O ' ' A' ' 31' ' ' GLU . 100.0 t -51.67 -50.22 31.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.21 -0.45 . . . . 65.129999999999995 111.096 179.937 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 7.5 mtp -51.97 -39.07 58.77 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.16 -0.473 . . . . 61.310000000000002 110.905 179.932 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 30.1 ttt85 -54.11 -40.15 67.04 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.179 -0.464 . . . . 63.5 110.837 -179.9 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . 0.611 ' OG ' HD21 ' M' ' 41' ' ' LEU . 3.8 t -76.8 -28.39 55.59 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.179 -0.464 . . . . 60.43 110.904 -179.809 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 1.009 HD13 ' HB3' ' M' ' 37' ' ' ALA . 58.6 mt -76.98 -21.49 54.63 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.127 -0.488 . . . . 72.510000000000005 110.909 179.986 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 101.45 31.11 5.65 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.753 -0.737 . . . . 73.319999999999993 112.476 179.858 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 2.2 tp-100 -116.96 140.32 49.61 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.842 0.353 . . . . 75.209999999999994 110.856 -179.85 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 29.8 t30 -109.87 76.8 0.99 Allowed Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.63 0.729 . . . . 72.120000000000005 110.913 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.75 140.0 41.64 Favored 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.71 2.274 . . . . 60.020000000000003 112.311 179.951 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 19.9 p -97.29 158.35 15.5 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.2 -0.454 . . . . 74.540000000000006 111.157 -179.986 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -51.94 -43.41 63.46 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.225 -0.443 . . . . 75.420000000000002 110.914 179.966 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.36 -32.93 64.81 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.18 -0.463 . . . . 65.319999999999993 111.088 179.937 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 11.0 tt0 -67.57 -50.77 56.85 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.194 -0.457 . . . . 55.439999999999998 110.89 -179.936 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.66 ' HB3' HG22 ' A' ' 29' ' ' THR . 45.9 mt -55.05 -51.85 65.02 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.172 -0.467 . . . . 70.200000000000003 110.951 179.984 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 29.8 tp60 -57.24 -29.07 63.47 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.148 -0.478 . . . . 65.329999999999998 110.94 179.89 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -72.17 -37.6 69.3 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.208 -0.451 . . . . 72.099999999999994 110.881 179.964 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . 0.49 ' O ' HG22 ' A' ' 55' ' ' VAL . 5.7 mtp -63.7 -57.89 8.59 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.172 -0.467 . . . . 73.329999999999998 110.858 179.985 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.685 HD12 HG23 ' A' ' 29' ' ' THR . 62.4 mt -54.89 -45.27 75.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.243 -0.435 . . . . 74.409999999999997 111.143 179.972 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 76.8 m-20 -66.32 -33.84 76.63 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.183 -0.462 . . . . 71.329999999999998 110.884 179.921 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -63.12 -30.56 71.68 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.212 -0.449 . . . . 75.010000000000005 110.861 -179.965 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.49 HG22 ' O ' ' A' ' 51' ' ' MET . 4.8 m -111.12 18.98 7.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.162 -0.472 . . . . 73.150000000000006 111.095 -179.987 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 31.5 t0 -89.99 93.06 9.25 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.205 -0.452 . . . . 63.109999999999999 110.889 179.893 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.16 -33.71 18.1 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.249 -0.432 . . . . 71.150000000000006 111.079 179.962 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 14.7 p30 -91.35 -0.15 57.61 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.226 -0.443 . . . . 35.520000000000003 110.868 179.962 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 52.35 59.54 8.86 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.726 -0.75 . . . . 70.409999999999997 112.496 -179.899 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 51.5 p-10 -114.48 -15.73 12.01 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.833 0.349 . . . . 70.230000000000004 110.919 -179.926 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 89.77 18.46 51.32 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.715 -0.755 . . . . 72.230000000000004 112.505 179.966 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . 0.672 HG22 HG22 ' A' ' 28' ' ' THR . 22.5 p -152.65 159.37 43.2 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.788 0.328 . . . . 54.32 111.167 -179.914 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.465 HG21 ' HD1' ' A' ' 68' ' ' PHE . 25.1 mt -91.94 109.48 21.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.215 -0.448 . . . . 75.400000000000006 111.137 179.907 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.4 t0 -73.82 -176.42 2.43 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.152 -0.476 . . . . 70.510000000000005 110.867 179.875 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.534 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 2.5 t80 -62.85 -58.32 17.19 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-O 121.652 0.739 . . . . 72.299999999999997 110.914 -179.887 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . 0.534 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 53.7 Cg_endo -69.81 -30.02 22.7 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.697 2.264 . . . . 52.130000000000003 112.344 179.982 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 -57.24 -41.47 79.6 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.205 -0.452 . . . . 72.129999999999995 110.918 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . 0.465 ' HD1' HG21 ' A' ' 63' ' ' ILE . 24.2 t80 -74.14 -36.1 64.12 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.106 -0.497 . . . . 75.400000000000006 110.886 -179.971 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 28.9 tp -65.48 -53.65 39.5 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.155 -0.475 . . . . 72.140000000000001 110.887 -179.937 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 11.2 t -54.02 -26.69 27.61 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.247 -0.433 . . . . 74.439999999999998 111.129 179.967 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . 0.411 ' SD ' HD23 ' M' ' 31' ' ' LEU . 42.9 ttp -70.67 -35.46 72.85 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.208 -0.451 . . . . 73.430000000000007 110.89 179.937 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 11.1 mtp -77.69 -33.72 53.14 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.213 -0.449 . . . . 73.239999999999995 110.888 179.938 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -74.84 -46.05 39.08 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.227 -0.442 . . . . 54.310000000000002 111.059 179.958 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 22.8 ttm180 -52.53 -34.8 51.6 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.238 -0.437 . . . . 75.530000000000001 110.926 -179.909 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -81.34 -27.09 35.1 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.15 -0.477 . . . . 74.349999999999994 110.835 179.978 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 11.0 tpt -60.7 -26.15 66.93 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.242 -0.435 . . . . 73.200000000000003 110.868 179.886 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 20.0 tptp -151.04 89.66 1.54 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.234 -0.439 . . . . 73.329999999999998 110.907 179.939 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -106.71 179.82 4.16 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.261 -0.427 . . . . 73.430000000000007 110.863 179.837 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 1.8 m -104.43 25.24 10.44 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.144 -0.48 . . . . 72.019999999999996 111.13 -179.927 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -86.66 -33.49 20.08 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.231 -0.44 . . . . 72.340000000000003 110.885 179.859 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 4.5 t -52.38 -37.05 55.41 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.197 -0.456 . . . . 71.030000000000001 110.868 -179.762 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.755 ' HA ' HD12 ' A' ' 85' ' ' ILE . 4.9 tm-20 -52.31 -29.86 25.53 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.1 -0.5 . . . . 61.200000000000003 110.91 -179.933 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 6.6 tt0 -63.88 -40.71 97.16 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.163 -0.472 . . . . 75.319999999999993 110.836 -179.906 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 11.1 tp10 -77.89 -38.47 45.69 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.15 -0.477 . . . . 65.430000000000007 110.898 -179.914 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.755 HD12 ' HA ' ' A' ' 82' ' ' GLU . 54.8 mt -55.48 -51.0 62.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.131 -0.486 . . . . 71.420000000000002 111.133 179.988 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.16 -30.3 26.15 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.104 -0.498 . . . . 73.109999999999999 110.882 179.988 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.411 ' O ' HG23 ' A' ' 91' ' ' VAL . 11.1 tt0 -76.41 -56.95 4.16 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.211 -0.449 . . . . 74.299999999999997 110.866 -179.953 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . 0.503 ' HB1' ' CE2' ' A' ' 92' ' ' PHE . . . -54.82 -43.23 72.78 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.141 -0.482 . . . . 73.5 111.089 179.962 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 8.8 t80 -52.02 -51.19 59.01 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.226 -0.443 . . . . 75.209999999999994 110.892 -179.953 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 50.3 ttt-85 -58.84 -44.89 91.07 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.124 -0.489 . . . . 73.239999999999995 110.902 -179.939 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . 0.411 HG23 ' O ' ' A' ' 87' ' ' GLU . 57.6 t -54.67 -49.36 68.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.178 -0.465 . . . . 63.240000000000002 111.185 179.938 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.503 ' CE2' ' HB1' ' A' ' 88' ' ' ALA . 8.9 m-85 -70.92 -32.36 69.26 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.149 -0.478 . . . . 72.150000000000006 110.889 179.986 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 16.6 t0 -61.71 96.72 0.07 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.175 -0.466 . . . . 75.209999999999994 110.822 179.983 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 58.2 mmtt -76.24 -53.17 8.64 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.175 -0.466 . . . . 60.020000000000003 110.876 179.993 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 56.0 p-10 -76.02 -9.17 58.4 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.216 -0.447 . . . . 72.439999999999998 110.872 179.868 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 59.64 26.87 63.03 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.733 -0.746 . . . . 24.43 112.45 -179.96 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 42.4 p-10 -81.77 -16.17 51.87 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.863 0.363 . . . . 75.099999999999994 110.908 -179.956 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 91.89 18.75 42.63 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.748 -0.739 . . . . 73.209999999999994 112.494 -179.998 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 6.2 m-85 -136.42 159.32 42.12 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.855 0.36 . . . . 72.019999999999996 110.907 -179.802 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 62.8 mt -122.4 123.95 69.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.143 -0.48 . . . . 65.409999999999997 111.127 179.93 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 63.2 p -107.17 -172.58 2.11 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.175 -0.466 . . . . 54.119999999999997 110.835 -179.913 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . 0.675 ' O ' HG11 ' A' ' 121' ' ' VAL . . . -73.96 -36.6 64.6 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.112 -0.494 . . . . 55.030000000000001 111.056 179.935 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -72.0 -31.37 66.16 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.228 -0.442 . . . . 73.510000000000005 111.11 179.983 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -74.9 -48.69 23.39 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.163 -0.471 . . . . 71.530000000000001 110.882 -179.924 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 22.1 tp -54.02 -47.89 71.05 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.162 -0.472 . . . . 74.219999999999999 110.937 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . 0.56 ' O ' HG23 ' A' ' 110' ' ' THR . 42.2 ttp85 -52.37 -44.53 65.33 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.182 -0.463 . . . . 71.450000000000003 110.904 179.911 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 11.1 t60 -58.45 -34.53 70.94 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.202 -0.453 . . . . 74.030000000000001 110.832 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 92.7 t -67.04 -52.2 46.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.201 -0.454 . . . . 71.209999999999994 111.175 179.948 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . 0.421 ' HA ' HD12 ' A' ' 112' ' ' LEU . 4.2 mmt -64.2 -46.07 85.5 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.139 -0.482 . . . . 61.329999999999998 110.85 179.905 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . 0.56 HG23 ' O ' ' A' ' 106' ' ' ARG . 41.8 p -51.88 -37.16 51.18 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.24 -0.436 . . . . 61.32 111.174 -179.933 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 43.8 t30 -57.86 -33.7 68.96 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.211 -0.45 . . . . 72.340000000000003 110.916 179.953 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.699 HD13 ' HE3' ' M' ' 18' ' ' LYS . 15.3 mt -70.7 -23.9 62.55 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.151 -0.477 . . . . 72.400000000000006 110.908 179.943 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 101.06 32.93 5.13 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.714 -0.755 . . . . 74.319999999999993 112.428 179.883 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -110.07 116.27 31.26 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.92 0.391 . . . . 74.239999999999995 110.898 -179.918 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 29.3 tttm -60.73 120.29 9.79 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.153 -0.476 . . . . 73.310000000000002 110.931 179.96 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.452 HD22 ' HG2' ' A' ' 120' ' ' GLU . 19.8 mt -145.88 155.42 42.87 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.246 -0.434 . . . . 71.040000000000006 110.897 179.92 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 41.0 p -118.73 169.03 10.18 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.168 -0.469 . . . . 72.420000000000002 111.177 179.943 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 41.2 m-20 -53.07 -46.08 68.43 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.268 -0.424 . . . . 72.420000000000002 110.897 179.887 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 17.9 tt0 -63.54 -34.23 77.35 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.188 -0.46 . . . . 71.329999999999998 110.867 -179.921 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . 0.452 ' HG2' HD22 ' A' ' 116' ' ' LEU . 2.3 tp10 -67.23 -32.65 73.84 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.186 -0.461 . . . . 64.329999999999998 110.871 -179.902 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.675 HG11 ' O ' ' A' ' 102' ' ' ALA . 92.8 t -69.48 -32.67 53.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.154 -0.475 . . . . 62.310000000000002 111.137 179.971 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 10.8 t0 -51.95 -46.92 64.92 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.18 -0.464 . . . . 63.32 110.878 179.948 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -55.74 -29.3 59.32 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.131 -0.486 . . . . 72.5 110.873 -179.898 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 1.2 mtp -75.37 -59.74 2.61 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.155 -0.475 . . . . 65.209999999999994 110.866 -179.997 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 35.5 mm -54.13 -35.61 29.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.215 -0.448 . . . . 71.329999999999998 111.11 179.977 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 51.2 ttt180 -63.03 -31.78 72.99 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.174 -0.466 . . . . 74.510000000000005 110.893 179.957 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 9.7 tt0 -75.33 -52.48 10.71 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.183 -0.462 . . . . 71.319999999999993 110.883 -179.893 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.528 ' HB3' ' CG2' ' A' ' 136' ' ' VAL . . . -64.92 -33.87 77.07 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.117 -0.492 . . . . 52.439999999999998 111.071 179.959 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 49.5 t0 -68.73 86.31 0.32 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.238 -0.437 . . . . 73.329999999999998 110.882 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . 0.694 HD12 ' HG2' ' A' ' 140' ' ' GLU . 4.0 mt -79.91 -45.72 22.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.229 -0.442 . . . . 75.019999999999996 111.128 -179.952 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 22.0 p30 -72.77 -8.8 57.18 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.184 -0.462 . . . . 73.409999999999997 110.88 179.823 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 62.86 44.41 97.48 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.73 -0.748 . . . . 55.539999999999999 112.518 -179.891 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 31.8 p-10 -90.44 -15.95 29.92 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.841 0.353 . . . . 75.239999999999995 110.882 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 101.97 3.77 51.62 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.726 -0.75 . . . . 75.209999999999994 112.518 -179.906 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 4.4 tt0 -149.29 172.31 15.09 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.873 0.368 . . . . 75.409999999999997 110.91 -179.857 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 136' ' ' VAL . . . . . 0.528 ' CG2' ' HB3' ' A' ' 128' ' ' ALA . 66.9 t -114.78 111.09 34.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.187 -0.461 . . . . 53.149999999999999 111.166 179.964 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 45.4 p-10 -93.67 171.66 8.75 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.17 -0.468 . . . . 70.400000000000006 110.915 -179.986 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . 0.701 ' O ' HG23 ' A' ' 142' ' ' VAL . 86.9 t80 -56.18 -46.83 79.21 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.232 -0.44 . . . . 72.420000000000002 110.901 -179.901 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 22.1 tt0 -52.11 -44.56 64.51 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.097 -0.501 . . . . 63.030000000000001 110.914 -179.981 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . 0.694 ' HG2' HD12 ' A' ' 130' ' ' ILE . 94.9 mt-10 -73.94 -40.26 63.2 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.166 -0.47 . . . . 62.509999999999998 110.87 -179.929 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . 0.562 ' HE1' HG23 ' A' ' 85' ' ' ILE . 42.7 t80 -60.47 -41.34 93.97 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.176 -0.465 . . . . 72.010000000000005 110.884 -179.936 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . 0.701 HG23 ' O ' ' A' ' 138' ' ' TYR . 99.7 t -60.19 -49.46 84.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.165 -0.47 . . . . 72.239999999999995 111.162 179.963 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . 0.548 ' HA ' HG22 ' A' ' 146' ' ' THR . 29.7 tt0 -72.28 -23.47 61.19 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.191 -0.459 . . . . 75.200000000000003 110.911 179.994 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 10.8 tpt -74.99 -18.79 60.31 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.241 -0.436 . . . . 72.310000000000002 110.872 179.958 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 9.2 ttm -98.22 -32.93 11.31 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.214 -0.448 . . . . 74.099999999999994 110.894 179.94 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 146' ' ' THR . . . . . 0.548 HG22 ' HA ' ' A' ' 143' ' ' GLN . 5.0 t -73.35 -24.15 60.31 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.243 -0.435 . . . . 43.149999999999999 111.11 -179.91 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -65.94 141.72 58.12 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.216 -0.447 . . . . 73.040000000000006 111.096 179.838 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.3 0 CA-C-N 116.192 -0.458 . . . . 72.530000000000001 110.904 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' M' M ' 8' ' ' LEU . . . . . . . . . . . . . 6.9 tp . . . . . 0 C--O 1.231 0.089 0 CA-C-O 120.836 0.35 . . . . 75.230000000000004 110.945 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' M' M ' 9' ' ' SER . . . . . . . . . . . . . 6.9 t 55.97 -176.91 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.17 -0.468 . . . . 65.219999999999999 110.875 -179.895 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' M' M ' 10' ' ' GLY . . . . . . . . . . . . . . . -138.19 -79.48 0.08 OUTLIER Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.755 -0.736 . . . . 74.310000000000002 112.468 -179.953 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' M' M ' 11' ' ' GLY . . . . . . . . . . . . . . . 83.3 -54.31 4.95 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.754 -0.736 . . . . 72.349999999999994 112.527 -179.891 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' M' M ' 12' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -82.74 128.13 34.08 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.908 0.385 . . . . 72.409999999999997 110.853 -179.877 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' M' M ' 13' ' ' LEU . . . . . . . . . . . . . 15.0 tp -51.72 122.81 8.79 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.186 -0.461 . . . . 65.049999999999997 110.909 -179.999 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' M' M ' 14' ' ' ASP . . . . . . . . . . . . . 35.0 t0 -107.63 73.64 0.92 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.169 -0.469 . . . . 70.510000000000005 110.864 179.854 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' M' M ' 15' ' ' LYS . . . . . . . . . . . . . 3.0 mttp -62.65 -17.07 59.73 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.179 -0.464 . . . . 54.340000000000003 110.901 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' M' M ' 16' ' ' TRP . . . . . . . . . . . . . 73.9 m95 -50.85 -32.74 21.26 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.199 -0.455 . . . . 71.230000000000004 110.929 179.918 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' M' M ' 17' ' ' GLU . . . . . . . . . . . . . 59.1 tt0 -54.08 -34.54 60.41 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.218 -0.447 . . . . 73.319999999999993 110.914 179.998 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' M' M ' 18' ' ' LYS . . . . . 0.699 ' HE3' HD13 ' A' ' 112' ' ' LEU . 23.4 tttp -65.16 -28.55 69.48 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.152 -0.476 . . . . 71.420000000000002 110.908 179.953 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' M' M ' 19' ' ' ILE . . . . . . . . . . . . . 28.6 mt -90.7 -29.98 4.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.214 -0.448 . . . . 64.219999999999999 111.157 179.879 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' M' M ' 20' ' ' ARG . . . . . . . . . . . . . 39.0 ttp85 -54.32 -28.05 39.89 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.147 -0.479 . . . . 75.430000000000007 110.87 179.928 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' M' M ' 21' ' ' LEU . . . . . . . . . . . . . 5.0 mt 57.64 -175.13 0.07 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.182 -0.463 . . . . 73.450000000000003 110.914 -179.959 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' M' M ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -108.96 144.14 29.03 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.614 0.721 . . . . 73.299999999999997 110.829 179.97 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' M' M ' 23' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.81 -48.29 0.74 Allowed 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.652 2.235 . . . . 75.310000000000002 112.326 179.987 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' M' M ' 24' ' ' GLY . . . . . . . . . . . . . . . 87.56 -74.5 2.23 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.694 -0.765 . . . . 73.420000000000002 112.466 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' M' M ' 25' ' ' GLY . . . . . . . . . . . . . . . 156.45 -107.56 0.33 Allowed Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.77 -0.729 . . . . 62.539999999999999 112.515 -179.91 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' M' M ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 39.4 41.6 0.72 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.871 0.367 . . . . 74.299999999999997 110.911 -179.976 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' M' M ' 27' ' ' LYS . . . . . . . . . . . . . 11.7 mmmt -92.54 172.88 8.09 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.26 -0.427 . . . . 75.439999999999998 110.912 179.875 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' M' M ' 28' ' ' GLN . . . . . . . . . . . . . 36.0 mm-40 -55.29 -70.03 0.12 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.263 -0.426 . . . . 61.119999999999997 110.918 179.946 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' M' M ' 29' ' ' TYR . . . . . . . . . . . . . 5.0 m-85 -52.15 123.77 11.42 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.194 -0.457 . . . . 62.0 110.935 -179.869 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' M' M ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.02 34.91 4.58 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.133 -0.485 . . . . 53.420000000000002 110.891 179.913 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' M' M ' 31' ' ' LEU . . . . . 0.896 HD12 HD12 ' M' ' 34' ' ' ILE . 14.8 tp -124.39 -41.44 2.17 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.262 -0.426 . . . . 70.420000000000002 110.926 179.935 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' M' M ' 32' ' ' LYS . . . . . . . . . . . . . 42.6 tttt -49.57 -42.87 45.49 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.178 -0.465 . . . . 53.140000000000001 110.909 179.827 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' M' M ' 33' ' ' HIS . . . . . . . . . . . . . 80.7 t60 -50.33 -39.19 45.27 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.185 -0.461 . . . . 73.540000000000006 110.851 179.912 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' M' M ' 34' ' ' ILE . . . . . 0.896 HD12 HD12 ' M' ' 31' ' ' LEU . 62.3 mt -50.7 -39.46 18.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.204 -0.453 . . . . 70.219999999999999 111.138 179.987 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' M' M ' 35' ' ' VAL . . . . . . . . . . . . . 98.9 t -49.8 -39.22 14.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.129 -0.487 . . . . 74.319999999999993 111.158 179.863 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' M' M ' 36' ' ' TRP . . . . . . . . . . . . . 29.9 m0 -58.85 -39.16 80.48 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.139 -0.482 . . . . 73.540000000000006 110.933 179.965 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' M' M ' 37' ' ' ALA . . . . . 1.009 ' HB3' HD13 ' A' ' 39' ' ' LEU . . . -63.9 -18.59 64.36 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.216 -0.447 . . . . 62.340000000000003 111.117 179.88 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' M' M ' 38' ' ' SER . . . . . 0.65 ' HB3' HD23 ' A' ' 18' ' ' LEU . 0.7 OUTLIER -73.94 -17.9 60.96 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.185 -0.461 . . . . 30.329999999999998 110.848 -179.742 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' M' M ' 39' ' ' ARG . . . . . . . . . . . . . 50.7 mtp180 -55.55 -31.4 62.11 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.131 -0.486 . . . . 72.129999999999995 110.85 -179.944 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' M' M ' 40' ' ' GLU . . . . . . . . . . . . . 14.3 tp10 -79.94 -46.53 16.55 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.156 -0.474 . . . . 73.519999999999996 110.89 -179.934 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' M' M ' 41' ' ' LEU . . . . . 0.611 HD21 ' OG ' ' A' ' 38' ' ' SER . 11.9 mt -61.4 116.09 4.39 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.14 -0.482 . . . . 72.409999999999997 110.89 -179.936 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' M' M ' 42' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -53.94 160.82 1.35 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.158 -0.474 . . . . 70.400000000000006 110.9 179.923 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' M' M ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.342 0 CA-C-N 116.169 -0.469 . . . . 73.329999999999998 110.906 -179.923 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 241' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 262' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 301' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 322' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.139 0 CA-C-O 120.794 0.331 . . . . 61.0 111.083 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -72.57 79.04 1.07 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.236 -0.438 . . . . 44.219999999999999 110.869 179.968 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 4.6 tt0 -105.93 36.44 2.56 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.2 -0.454 . . . . 74.340000000000003 110.948 -179.945 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.528 HD13 ' HG2' ' A' ' 8' ' ' GLN . 4.0 mm? -102.25 109.46 21.14 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.148 -0.478 . . . . 64.519999999999996 110.88 -179.986 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 5.5 p -100.38 176.71 5.27 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.185 -0.461 . . . . 51.149999999999999 111.119 179.937 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 20.6 tt0 -58.04 -36.23 72.45 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.217 -0.447 . . . . 74.430000000000007 110.919 -179.982 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 65.3 tt0 -67.66 -35.81 79.56 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.131 -0.486 . . . . 72.430000000000007 110.88 -179.949 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . 0.528 ' HG2' HD13 ' A' ' 4' ' ' LEU . 8.5 tp-100 -77.98 -41.43 36.06 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.199 -0.455 . . . . 72.109999999999999 110.942 -179.964 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 59.2 mt -70.5 -43.33 78.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.238 -0.437 . . . . 65.239999999999995 111.116 179.932 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -52.11 -29.62 22.54 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.21 -0.45 . . . . 55.549999999999997 111.078 179.847 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 43.7 mm-40 -74.66 -52.0 12.84 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.28 -0.418 . . . . 73.129999999999995 110.882 -179.952 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 24.2 m-85 -61.91 -46.04 91.08 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.153 -0.476 . . . . 75.310000000000002 110.845 -179.88 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 34.1 ttmt -55.33 -26.98 44.07 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.117 -0.492 . . . . 72.230000000000004 110.95 179.962 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 56.4 tt0 -72.61 -38.72 67.72 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.222 -0.445 . . . . 74.420000000000002 110.888 179.927 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -63.77 -43.4 96.5 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.181 -0.463 . . . . 73.5 111.103 179.942 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 67.1 t80 -57.12 -53.7 55.06 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.197 -0.456 . . . . 63.140000000000001 110.904 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 46.9 m -52.35 -34.24 46.53 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.133 -0.485 . . . . 74.129999999999995 110.871 -179.795 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.64 HD23 ' HB3' ' M' ' 38' ' ' SER . 16.6 tp -62.43 -46.68 87.46 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.09 -0.505 . . . . 70.230000000000004 110.913 179.996 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.491 ' CE1' HG11 ' A' ' 35' ' ' VAL . 46.2 m-85 -71.95 -25.98 62.1 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.2 -0.454 . . . . 44.310000000000002 110.877 179.933 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 13.9 t0 -82.69 98.54 9.11 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.138 -0.483 . . . . 72.310000000000002 110.852 179.995 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 15.8 ttmm -67.88 -51.76 44.37 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.168 -0.469 . . . . 63.039999999999999 110.863 -179.989 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 29.9 p-10 -79.57 -10.1 59.74 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.217 -0.447 . . . . 63.350000000000001 110.884 179.925 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 51.96 44.32 55.99 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.764 -0.732 . . . . 51.399999999999999 112.454 -179.938 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 17.2 p-10 -88.5 -15.72 34.55 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.813 0.339 . . . . 74.140000000000001 110.851 -179.989 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 102.24 17.09 21.19 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.716 -0.754 . . . . 64.109999999999999 112.521 -179.919 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -154.58 131.43 10.81 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.76 0.315 . . . . 51.409999999999997 111.133 -179.85 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.436 HG21 HD23 ' A' ' 32' ' ' LEU . 23.3 mt -92.51 111.67 24.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.256 -0.429 . . . . 64.25 111.128 179.941 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.698 HG22 HG21 ' A' ' 62' ' ' THR . 19.6 p -97.78 178.21 5.22 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.2 -0.454 . . . . 72.319999999999993 111.093 -179.989 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 3.0 p -62.77 -27.19 69.12 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.205 -0.452 . . . . 73.239999999999995 111.184 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 7.8 mmmm -69.78 -50.09 46.56 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.173 -0.467 . . . . 42.100000000000001 110.899 179.93 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.42 ' O ' HG23 ' A' ' 35' ' ' VAL . 33.6 mt-10 -74.24 -32.71 63.08 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.214 -0.448 . . . . 74.120000000000005 110.899 179.95 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.576 ' O ' HD13 ' A' ' 32' ' ' LEU . 1.0 OUTLIER -74.14 -41.26 61.82 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.145 -0.479 . . . . 75.510000000000005 110.912 179.996 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -70.67 -34.43 66.93 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.801 -0.714 . . . . 74.239999999999995 112.5 179.887 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 96.7 m -67.43 -59.88 3.02 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.784 0.326 . . . . 70.299999999999997 111.136 -179.809 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.491 HG11 ' CE1' ' A' ' 19' ' ' PHE . 66.7 t -52.94 -52.11 31.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.194 -0.457 . . . . 72.329999999999998 111.132 179.903 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 6.3 ttt -51.93 -29.97 22.5 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.179 -0.464 . . . . 74.409999999999997 110.902 179.899 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 3.7 tmm_? -72.65 -52.85 13.64 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.17 -0.468 . . . . 71.109999999999999 110.884 -179.971 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 4.6 t -58.52 -25.69 62.69 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.23 -0.441 . . . . 74.329999999999998 110.907 -179.811 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.98 HD13 ' HB3' ' M' ' 37' ' ' ALA . 61.2 mt -78.15 -13.88 59.69 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.101 -0.5 . . . . 64.340000000000003 110.936 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 101.5 23.88 9.19 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.778 -0.725 . . . . 52.350000000000001 112.518 179.936 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 8.3 tp-100 -124.59 129.35 50.4 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.785 0.326 . . . . 72.530000000000001 110.931 -179.904 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 61.1 t30 -109.71 82.46 2.31 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.591 0.71 . . . . 71.129999999999995 110.902 -179.957 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.8 167.97 22.95 Favored 'Trans proline' 0 C--O 1.232 0.221 0 C-N-CA 122.72 2.28 . . . . 52.43 112.324 179.988 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 20.5 p -112.53 155.47 24.27 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.249 -0.432 . . . . 61.329999999999998 111.195 -179.993 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -51.91 -40.51 60.84 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.227 -0.442 . . . . 52.130000000000003 110.886 179.984 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.44 -31.46 63.83 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.145 -0.48 . . . . 73.049999999999997 111.112 179.973 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -70.76 -49.71 43.82 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.217 -0.447 . . . . 73.329999999999998 110.873 -179.933 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.522 ' CD2' HD12 ' A' ' 32' ' ' LEU . 13.9 mt -55.07 -51.0 67.73 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.175 -0.466 . . . . 72.25 110.926 -179.986 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 15.4 tp60 -59.93 -28.39 67.58 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.171 -0.468 . . . . 75.25 110.906 179.928 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 38.3 t0 -74.63 -49.96 19.55 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.22 -0.446 . . . . 52.109999999999999 110.865 -179.996 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 14.6 ptm -66.92 -42.49 85.29 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.212 -0.449 . . . . 64.439999999999998 110.894 179.976 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 97.1 mt -65.83 -38.11 81.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.149 -0.478 . . . . 61.539999999999999 111.12 179.97 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 33.6 m-20 -62.28 -36.17 81.25 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.18 -0.464 . . . . 65.150000000000006 110.847 179.959 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 24.9 mm-40 -63.62 -29.73 70.94 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.216 -0.447 . . . . 64.340000000000003 110.9 -179.963 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.516 HG13 ' CE1' ' M' ' 29' ' ' TYR . 9.7 m -105.34 12.68 8.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.151 -0.477 . . . . 74.439999999999998 111.114 179.967 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 30.7 t0 -90.01 98.73 11.94 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.232 -0.44 . . . . 73.0 110.857 179.953 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.34 -44.71 10.59 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.21 -0.45 . . . . 32.450000000000003 111.1 179.957 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 41.2 p30 -82.93 -0.2 47.43 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.219 -0.446 . . . . 74.140000000000001 110.837 -179.999 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 55.2 55.34 28.78 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.731 -0.747 . . . . 62.399999999999999 112.477 -179.927 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 48.7 p-10 -114.64 -15.74 11.92 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.891 0.376 . . . . 72.219999999999999 110.867 -179.895 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 92.71 19.14 38.39 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.799 -0.715 . . . . 62.409999999999997 112.478 179.96 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . 0.698 HG21 HG22 ' A' ' 28' ' ' THR . 26.7 p -146.52 165.91 28.04 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.749 0.309 . . . . 43.240000000000002 111.148 -179.881 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.434 HD13 HD21 ' M' ' 31' ' ' LEU . 18.5 mt -96.23 109.43 22.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.219 -0.446 . . . . 72.329999999999998 111.132 179.915 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -74.04 -177.81 3.06 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.205 -0.452 . . . . 65.409999999999997 110.901 179.839 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.533 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 2.5 t80 -61.6 -58.35 18.98 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.636 0.731 . . . . 60.439999999999998 110.891 -179.886 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . 0.533 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 53.9 Cg_endo -69.78 -29.73 23.3 Favored 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.668 2.245 . . . . 65.510000000000005 112.299 -179.991 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 80.6 mt-10 -58.57 -40.02 81.95 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.268 -0.424 . . . . 73.019999999999996 110.868 -179.963 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 50.4 t80 -73.79 -36.05 65.0 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.119 -0.491 . . . . 72.400000000000006 110.894 -179.923 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 16.4 tp -68.84 -53.84 19.12 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.177 -0.465 . . . . 73.25 110.932 -179.976 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 14.1 t -52.9 -28.45 23.34 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.214 -0.448 . . . . 74.120000000000005 111.154 179.964 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 39.6 ttp -65.24 -42.46 93.35 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.231 -0.441 . . . . 71.430000000000007 110.873 179.876 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -71.97 -35.75 69.61 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.218 -0.447 . . . . 62.229999999999997 110.848 179.975 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -74.8 -29.62 61.15 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.237 -0.438 . . . . 70.430000000000007 111.078 179.926 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 16.6 ttm180 -64.84 -25.59 67.97 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.209 -0.45 . . . . 72.519999999999996 110.884 -179.887 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -51.96 -30.48 24.92 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.186 -0.461 . . . . 33.420000000000002 110.864 179.95 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 41.3 mtt -51.94 -41.56 62.14 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.272 -0.422 . . . . 73.25 110.893 179.886 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 7.1 mtmm -146.93 126.83 13.55 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.238 -0.437 . . . . 70.219999999999999 110.895 179.934 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -150.09 -74.68 0.16 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.215 -0.448 . . . . 75.150000000000006 110.857 179.859 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 13.5 t -112.4 161.96 16.1 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.162 -0.472 . . . . 65.530000000000001 111.154 -179.917 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 9.2 t0 71.66 2.64 4.36 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.244 -0.435 . . . . 72.409999999999997 110.819 179.901 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 70.9 m -80.14 -39.58 29.14 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.215 -0.448 . . . . 62.409999999999997 110.866 -179.778 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.7 ' HA ' HD12 ' A' ' 85' ' ' ILE . 3.4 tt0 -58.81 -38.49 78.72 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.17 -0.468 . . . . 73.310000000000002 110.853 -179.895 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -58.22 -44.15 88.06 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.167 -0.47 . . . . 61.310000000000002 110.865 -179.931 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -65.69 -32.99 74.85 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.207 -0.451 . . . . 74.450000000000003 110.895 -179.912 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.7 HD12 ' HA ' ' A' ' 82' ' ' GLU . 51.4 mt -68.19 -50.96 53.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.11 -0.495 . . . . 74.140000000000001 111.181 179.928 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 51.2 ttt180 -66.04 -33.5 75.94 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.131 -0.486 . . . . 75.209999999999994 110.847 179.969 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.681 ' O ' HG23 ' A' ' 91' ' ' VAL . 0.3 OUTLIER -76.41 -34.94 58.8 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.241 -0.436 . . . . 70.420000000000002 110.878 -179.912 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . 0.418 ' HB1' ' CE2' ' A' ' 92' ' ' PHE . . . -76.62 -34.49 58.35 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.149 -0.478 . . . . 45.039999999999999 111.086 179.94 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -61.57 -48.63 80.08 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.216 -0.447 . . . . 71.540000000000006 110.879 -179.936 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 12.9 ptm180 -60.76 -25.93 66.85 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.168 -0.469 . . . . 73.239999999999995 110.865 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . 0.681 HG23 ' O ' ' A' ' 87' ' ' GLU . 94.0 t -75.58 -51.21 21.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.234 -0.439 . . . . 73.049999999999997 111.136 179.98 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.455 ' CE1' HG11 ' A' ' 108' ' ' VAL . 8.9 m-85 -70.79 -26.61 63.4 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.184 -0.462 . . . . 73.409999999999997 110.882 -179.983 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 33.1 t0 -76.52 88.91 3.26 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.157 -0.474 . . . . 71.129999999999995 110.864 179.954 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 59.4 mmtt -75.31 -51.04 14.17 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.203 -0.453 . . . . 72.329999999999998 110.914 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 31.2 p30 -72.58 -9.08 58.15 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.233 -0.439 . . . . 51.520000000000003 110.882 179.857 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 59.96 27.72 65.06 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.765 -0.731 . . . . 73.420000000000002 112.527 -179.9 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 44.7 p-10 -82.88 -16.12 48.79 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.899 0.38 . . . . 74.5 110.909 -179.878 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 89.08 18.72 53.22 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.752 -0.737 . . . . 73.230000000000004 112.491 179.981 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 20.2 m-85 -137.51 152.39 49.44 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.824 0.345 . . . . 71.439999999999998 110.945 -179.798 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 65.2 mt -122.63 114.64 43.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.135 -0.484 . . . . 74.040000000000006 111.152 179.916 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 6.8 p -107.19 165.43 11.37 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.208 -0.451 . . . . 53.310000000000002 110.87 -179.926 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . 0.502 ' HB2' HG13 ' A' ' 125' ' ' ILE . . . -51.85 -29.83 21.21 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.136 -0.484 . . . . 50.310000000000002 111.11 179.904 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -68.92 -43.11 75.83 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.191 -0.459 . . . . 61.020000000000003 111.096 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 83.5 mt-10 -76.8 -49.4 15.95 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.185 -0.461 . . . . 55.549999999999997 110.916 -179.956 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 24.3 tp -53.31 -47.62 69.1 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.187 -0.46 . . . . 72.340000000000003 110.891 -179.981 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . 0.75 ' HB2' HG21 ' A' ' 121' ' ' VAL . 46.9 ttp180 -53.02 -31.31 40.45 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.219 -0.446 . . . . 73.519999999999996 110.887 179.954 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 63.0 t60 -69.27 -34.41 74.72 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.168 -0.469 . . . . 74.140000000000001 110.889 179.977 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.455 HG11 ' CE1' ' A' ' 92' ' ' PHE . 45.3 t -70.0 -32.24 50.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.238 -0.437 . . . . 75.420000000000002 111.113 -179.989 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 7.8 mmt -73.09 -43.75 61.36 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.158 -0.473 . . . . 63.329999999999998 110.844 179.931 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -54.99 -41.13 70.86 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.243 -0.435 . . . . 71.310000000000002 111.145 -179.907 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 61.0 m-20 -71.57 -32.24 67.86 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.203 -0.453 . . . . 72.409999999999997 110.88 179.997 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 5.0 mt -70.75 -25.75 63.05 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.148 -0.478 . . . . 75.439999999999998 110.923 179.959 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 101.07 32.42 5.3 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.787 -0.72 . . . . 65.209999999999994 112.454 179.88 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -113.75 109.97 19.42 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.896 0.379 . . . . 72.25 110.875 -179.861 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . 0.418 ' O ' HD23 ' A' ' 116' ' ' LEU . 0.6 OUTLIER -66.61 108.08 2.32 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.159 -0.473 . . . . 63.530000000000001 110.876 179.984 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.603 HD22 ' HG2' ' A' ' 120' ' ' GLU . 10.4 mt -143.63 160.38 40.77 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.218 -0.446 . . . . 55.109999999999999 110.954 179.894 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . 0.557 ' O ' HG23 ' A' ' 121' ' ' VAL . 31.9 p -118.86 177.01 5.01 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.217 -0.447 . . . . 73.200000000000003 111.139 179.986 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -57.05 -43.74 82.3 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.245 -0.434 . . . . 65.299999999999997 110.845 179.938 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -65.0 -33.44 76.06 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.212 -0.449 . . . . 71.310000000000002 110.845 -179.87 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . 0.603 ' HG2' HD22 ' A' ' 116' ' ' LEU . 1.2 tp10 -70.12 -43.92 70.0 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.143 -0.48 . . . . 72.25 110.926 -179.974 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.75 HG21 ' HB2' ' A' ' 106' ' ' ARG . 48.6 t -59.19 -31.94 47.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.155 -0.475 . . . . 54.399999999999999 111.114 179.976 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 11.7 t0 -52.01 -42.77 63.28 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.226 -0.443 . . . . 74.040000000000006 110.856 179.916 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -55.76 -32.65 63.61 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.179 -0.464 . . . . 73.5 110.895 -179.909 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 30.8 mtp -76.05 -59.17 2.88 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.164 -0.471 . . . . 71.109999999999999 110.882 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.502 HG13 ' HB2' ' A' ' 102' ' ' ALA . 36.0 mm -53.92 -35.73 28.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.218 -0.446 . . . . 73.5 111.12 179.931 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 24.0 ttm180 -63.44 -31.85 73.13 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.178 -0.464 . . . . 74.150000000000006 110.898 179.944 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 21.0 tp10 -74.75 -52.38 11.68 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.161 -0.472 . . . . 72.209999999999994 110.842 -179.901 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.653 ' HB3' HG22 ' A' ' 136' ' ' VAL . . . -65.21 -34.41 78.3 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.159 -0.473 . . . . 75.329999999999998 111.088 179.982 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 49.4 t0 -68.42 86.74 0.3 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.217 -0.447 . . . . 51.329999999999998 110.882 179.968 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 60.6 mt -79.81 -46.15 22.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.172 -0.467 . . . . 71.519999999999996 111.126 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 21.2 p30 -72.78 -8.7 56.7 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.151 -0.477 . . . . 51.439999999999998 110.874 179.864 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 62.7 42.97 99.61 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.692 -0.766 . . . . 70.200000000000003 112.505 -179.933 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 34.6 p-10 -88.05 -15.98 34.84 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.825 0.345 . . . . 71.299999999999997 110.877 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 103.98 2.41 45.58 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.761 -0.733 . . . . 73.129999999999995 112.501 -179.935 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -149.15 172.26 15.11 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.829 0.347 . . . . 74.140000000000001 110.939 -179.88 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 136' ' ' VAL . . . . . 0.653 HG22 ' HB3' ' A' ' 128' ' ' ALA . 95.6 t -107.8 111.06 34.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.204 -0.453 . . . . 74.200000000000003 111.127 179.939 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 44.2 p-10 -92.82 165.95 12.66 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.153 -0.476 . . . . 64.109999999999999 110.88 -179.967 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . 0.518 ' O ' HG23 ' A' ' 142' ' ' VAL . 58.9 t80 -51.97 -46.47 64.84 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.207 -0.451 . . . . 75.109999999999999 110.905 -179.906 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 -51.99 -40.89 61.65 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.113 -0.494 . . . . 72.150000000000006 110.867 -179.956 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 20.7 mt-10 -78.34 -39.81 38.36 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.2 -0.455 . . . . 62.439999999999998 110.876 -179.926 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 52.4 t80 -61.17 -38.66 87.29 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.15 -0.477 . . . . 74.439999999999998 110.87 -179.888 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . 0.518 HG23 ' O ' ' A' ' 138' ' ' TYR . 93.8 t -71.26 -37.95 68.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.119 -0.491 . . . . 54.439999999999998 111.11 179.961 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 3.4 tp-100 -71.56 -31.25 66.79 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.185 -0.461 . . . . 54.210000000000001 110.895 -179.955 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 9.0 tpt -74.7 -42.43 58.39 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.193 -0.458 . . . . 73.540000000000006 110.867 179.964 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 9.6 ttm -79.34 -26.07 42.19 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.236 -0.438 . . . . 71.340000000000003 110.875 179.967 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 2.6 m -110.75 21.26 16.73 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.23 -0.441 . . . . 62.210000000000001 111.14 -179.924 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -60.47 -170.51 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.245 -0.434 . . . . 33.200000000000003 111.086 179.894 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 7.3 mmmm . . . . . 0 C--N 1.329 -0.32 0 CA-C-N 116.192 -0.458 . . . . 71.310000000000002 110.902 179.991 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' M' M ' 8' ' ' LEU . . . . . . . . . . . . . 9.3 mp . . . . . 0 C--O 1.231 0.08 0 CA-C-O 120.8 0.333 . . . . 61.240000000000002 110.91 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' M' M ' 9' ' ' SER . . . . . . . . . . . . . 12.2 p -155.92 177.82 10.98 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.151 -0.477 . . . . 71.430000000000007 110.821 -179.971 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' M' M ' 10' ' ' GLY . . . . . . . . . . . . . . . 161.87 146.06 4.53 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.782 -0.723 . . . . 63.119999999999997 112.521 -179.981 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' M' M ' 11' ' ' GLY . . . . . . . . . . . . . . . 100.59 -33.69 6.18 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.744 -0.741 . . . . 72.099999999999994 112.465 -179.964 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' M' M ' 12' ' ' GLU . . . . . . . . . . . . . 54.4 mt-10 -87.27 -179.14 6.36 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.886 0.375 . . . . 74.430000000000007 110.869 -179.865 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' M' M ' 13' ' ' LEU . . . . . 0.403 HD22 ' HA ' ' M' ' 13' ' ' LEU . 0.8 OUTLIER -87.79 75.81 8.86 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.133 -0.485 . . . . 71.319999999999993 110.91 -179.965 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' M' M ' 14' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -102.87 26.11 8.5 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.152 -0.476 . . . . 75.329999999999998 110.891 179.794 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' M' M ' 15' ' ' LYS . . . . . . . . . . . . . 60.9 mttp -66.17 -57.16 8.23 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.223 -0.444 . . . . 73.230000000000004 110.894 179.986 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' M' M ' 16' ' ' TRP . . . . . 0.468 ' CE3' HD12 ' M' ' 19' ' ' ILE . 19.7 m95 -54.34 -39.31 66.96 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.244 -0.434 . . . . 71.450000000000003 110.862 179.983 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' M' M ' 17' ' ' GLU . . . . . . . . . . . . . 41.0 tp10 -56.45 -26.81 54.97 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.243 -0.435 . . . . 62.420000000000002 110.883 -179.974 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' M' M ' 18' ' ' LYS . . . . . . . . . . . . . 6.9 ttpm? -78.61 -25.87 45.21 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.171 -0.468 . . . . 73.209999999999994 110.897 179.984 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' M' M ' 19' ' ' ILE . . . . . 0.468 HD12 ' CE3' ' M' ' 16' ' ' TRP . 29.6 mt -89.88 -25.22 5.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.187 -0.46 . . . . 71.109999999999999 111.14 179.874 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' M' M ' 20' ' ' ARG . . . . . . . . . . . . . 22.5 ttt180 -54.37 -40.21 67.91 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.174 -0.466 . . . . 73.439999999999998 110.903 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' M' M ' 21' ' ' LEU . . . . . . . . . . . . . 4.1 mt 52.91 -170.33 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.164 -0.471 . . . . 71.209999999999994 110.942 -179.997 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' M' M ' 22' ' ' ARG . . . . . . . . . . . . . 3.0 mmt180 60.01 79.39 0.3 Allowed Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.595 0.712 . . . . 73.310000000000002 110.914 179.952 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' M' M ' 23' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.76 -28.0 25.79 Favored 'Trans proline' 0 C--N 1.342 0.204 0 C-N-CA 122.705 2.27 . . . . 72.340000000000003 112.358 -179.967 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' M' M ' 24' ' ' GLY . . . . . . . . . . . . . . . -150.68 169.07 30.52 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.78 -0.724 . . . . 40.539999999999999 112.489 179.986 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' M' M ' 25' ' ' GLY . . . . . . . . . . . . . . . -105.12 -118.96 4.54 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.725 -0.75 . . . . 62.340000000000003 112.445 -179.871 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' M' M ' 26' ' ' LYS . . . . . . . . . . . . . 6.0 ttpm? -148.18 -74.23 0.19 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.842 0.353 . . . . 74.219999999999999 110.891 -179.988 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' M' M ' 27' ' ' LYS . . . . . . . . . . . . . 17.0 ttpt -176.25 133.19 0.24 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.253 -0.43 . . . . 74.430000000000007 110.902 179.851 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' M' M ' 28' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -176.36 52.63 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.214 -0.448 . . . . 71.430000000000007 110.88 179.941 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' M' M ' 29' ' ' TYR . . . . . 0.516 ' CE1' HG13 ' A' ' 55' ' ' VAL . 0.3 OUTLIER -154.88 -47.08 0.08 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.216 -0.447 . . . . 60.329999999999998 110.969 -179.894 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' M' M ' 30' ' ' LYS . . . . . . . . . . . . . 3.0 ttmm 61.15 27.35 17.15 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.092 -0.504 . . . . 74.239999999999995 110.892 179.888 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' M' M ' 31' ' ' LEU . . . . . 0.434 HD21 HD13 ' A' ' 63' ' ' ILE . 9.5 tp -127.33 -52.28 1.39 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.196 -0.456 . . . . 75.439999999999998 110.933 179.926 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' M' M ' 32' ' ' LYS . . . . . . . . . . . . . 3.2 ttpp -47.65 -47.08 29.41 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.212 -0.449 . . . . 63.539999999999999 110.918 179.792 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' M' M ' 33' ' ' HIS . . . . . . . . . . . . . 74.8 t60 -50.45 -39.87 48.93 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.201 -0.454 . . . . 70.109999999999999 110.838 179.924 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' M' M ' 34' ' ' ILE . . . . . . . . . . . . . 50.1 mt -50.73 -39.27 18.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.236 -0.438 . . . . 65.420000000000002 111.123 -180.0 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' M' M ' 35' ' ' VAL . . . . . . . . . . . . . 61.1 t -49.27 -39.93 13.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.194 -0.457 . . . . 75.519999999999996 111.098 179.895 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' M' M ' 36' ' ' TRP . . . . . . . . . . . . . 22.8 m0 -59.02 -39.5 82.12 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.168 -0.469 . . . . 71.510000000000005 110.95 179.958 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' M' M ' 37' ' ' ALA . . . . . 0.98 ' HB3' HD13 ' A' ' 39' ' ' LEU . . . -63.71 -18.69 64.28 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.205 -0.452 . . . . 74.25 111.069 179.874 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' M' M ' 38' ' ' SER . . . . . 0.64 ' HB3' HD23 ' A' ' 18' ' ' LEU . 1.2 m -69.3 -17.96 63.78 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.24 -0.436 . . . . 72.5 110.871 -179.769 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' M' M ' 39' ' ' ARG . . . . . . . . . . . . . 26.4 ptt180 -56.11 -25.38 45.64 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.107 -0.497 . . . . 74.150000000000006 110.877 -179.916 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' M' M ' 40' ' ' GLU . . . . . . . . . . . . . 41.6 mm-40 -88.1 -47.99 8.07 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.188 -0.46 . . . . 42.340000000000003 110.914 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' M' M ' 41' ' ' LEU . . . . . . . . . . . . . 12.9 mt -60.39 168.4 2.1 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.165 -0.47 . . . . 70.310000000000002 110.97 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' M' M ' 42' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -156.95 -48.65 0.07 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.174 -0.466 . . . . 75.109999999999999 110.896 179.945 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' M' M ' 43' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.321 0 CA-C-N 116.153 -0.476 . . . . 54.409999999999997 110.859 -179.956 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 241' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 262' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 301' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 322' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.085 0 CA-C-O 120.806 0.336 . . . . 60.200000000000003 111.1 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -105.35 -175.67 2.86 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.197 -0.456 . . . . 73.25 110.845 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . 0.523 ' O ' HD23 ' A' ' 4' ' ' LEU . 31.8 mm-40 -74.23 -74.51 0.19 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.202 -0.454 . . . . 71.510000000000005 110.893 -179.879 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.523 HD23 ' O ' ' A' ' 3' ' ' GLN . 7.7 mt -134.18 149.96 51.06 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.155 -0.475 . . . . 73.319999999999993 110.932 179.998 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 31.2 p -119.01 177.73 4.76 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.202 -0.454 . . . . 71.129999999999995 111.151 179.924 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 11.9 tm-20 -56.46 -30.09 62.48 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.231 -0.44 . . . . 73.420000000000002 110.87 -179.949 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 58.2 tt0 -67.47 -39.92 85.31 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.164 -0.471 . . . . 74.120000000000005 110.879 -179.931 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 8.0 tp60 -77.78 -36.78 50.09 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.165 -0.47 . . . . 71.030000000000001 110.908 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 59.4 mt -72.56 -38.39 59.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.199 -0.455 . . . . 72.219999999999999 111.088 179.989 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -65.91 -27.02 67.88 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.228 -0.442 . . . . 54.310000000000002 111.137 179.807 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 20.6 mm-40 -74.83 -44.75 47.56 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.173 -0.467 . . . . 65.230000000000004 110.9 -179.933 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 23.8 m-85 -75.26 -45.81 37.68 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.157 -0.474 . . . . 61.020000000000003 110.853 -179.913 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 27.0 ttmt -56.36 -44.53 80.2 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.149 -0.478 . . . . 73.340000000000003 110.888 179.976 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -52.99 -32.65 47.61 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.202 -0.454 . . . . 72.400000000000006 110.84 -179.993 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -67.51 -42.2 83.23 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.193 -0.458 . . . . 72.040000000000006 111.109 179.916 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 66.6 t80 -56.07 -53.51 56.18 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.199 -0.455 . . . . 61.32 110.899 -179.914 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 70.9 m -55.85 -27.21 50.54 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.141 -0.481 . . . . 41.229999999999997 110.855 -179.796 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 15.5 tp -67.77 -40.25 84.04 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.182 -0.463 . . . . 71.349999999999994 110.947 179.964 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.672 ' HA ' HG21 ' A' ' 35' ' ' VAL . 59.5 m-85 -82.43 -34.48 28.2 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.228 -0.442 . . . . 75.109999999999999 110.853 179.93 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 11.0 t0 -69.47 98.52 1.12 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.192 -0.458 . . . . 64.209999999999994 110.859 -179.999 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 45.4 mmtt -72.09 -56.14 6.12 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.169 -0.469 . . . . 63.240000000000002 110.869 -179.978 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 26.5 p-10 -73.94 -10.01 59.22 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.2 -0.455 . . . . 53.409999999999997 110.876 179.893 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 51.99 44.6 56.41 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.762 -0.732 . . . . 74.129999999999995 112.529 -179.9 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 26.5 p-10 -88.51 -15.77 34.41 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.878 0.371 . . . . 72.530000000000001 110.89 -179.979 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 104.67 -11.72 50.08 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.74 -0.743 . . . . 72.019999999999996 112.47 -179.953 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 20.7 p -131.04 130.68 43.58 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.715 0.293 . . . . 74.310000000000002 111.166 -179.851 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 21.2 mt -90.47 130.84 39.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.292 -0.413 . . . . 62.439999999999998 111.096 179.919 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 29.8 p -108.75 -176.83 3.15 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.188 -0.46 . . . . 73.129999999999995 111.141 179.963 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.512 HG23 HD12 ' A' ' 52' ' ' ILE . 7.6 p -65.61 -41.5 92.69 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.247 -0.433 . . . . 73.209999999999994 111.126 -179.985 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 79.8 mttt -68.23 -50.15 55.91 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.206 -0.452 . . . . 73.150000000000006 110.902 179.935 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 27.4 mt-10 -56.36 -32.65 64.94 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.187 -0.461 . . . . 72.040000000000006 110.882 179.992 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.559 ' O ' HD13 ' A' ' 32' ' ' LEU . 0.9 OUTLIER -73.13 -43.14 62.07 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.156 -0.475 . . . . 50.229999999999997 110.926 179.988 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -69.73 -27.86 72.77 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.742 -0.742 . . . . 73.219999999999999 112.448 179.933 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 46.6 m -64.68 -59.51 4.18 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.841 0.353 . . . . 42.130000000000003 111.177 -179.896 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.672 HG21 ' HA ' ' A' ' 19' ' ' PHE . 99.9 t -57.38 -50.35 77.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.233 -0.439 . . . . 64.430000000000007 111.169 179.864 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 1.9 ttt -55.08 -30.42 59.63 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.166 -0.47 . . . . 75.109999999999999 110.907 179.88 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 23.9 ttm180 -60.1 -50.67 72.8 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.223 -0.444 . . . . 73.530000000000001 110.9 -179.96 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . 0.587 ' OG ' HD21 ' M' ' 41' ' ' LEU . 1.6 t -61.34 -26.17 67.64 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.16 -0.473 . . . . 63.039999999999999 110.853 -179.751 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 1.0 HD13 ' HB3' ' M' ' 37' ' ' ALA . 58.2 mt -73.84 -20.5 60.42 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.096 -0.502 . . . . 71.150000000000006 110.93 179.963 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 101.5 29.62 6.21 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.715 -0.755 . . . . 75.230000000000004 112.467 179.886 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 10.5 mm-40 -127.46 133.97 49.87 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.796 0.331 . . . . 73.120000000000005 110.918 -179.882 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 10.7 t-20 -109.27 86.24 4.03 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.609 0.718 . . . . 70.129999999999995 110.875 -179.984 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.78 167.89 23.16 Favored 'Trans proline' 0 C--O 1.231 0.167 0 C-N-CA 122.709 2.272 . . . . 75.030000000000001 112.306 179.934 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 19.3 p -111.79 156.49 21.89 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.187 -0.461 . . . . 54.240000000000002 111.152 179.997 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 12.3 tp10 -51.97 -40.81 61.47 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.244 -0.435 . . . . 74.230000000000004 110.882 179.973 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.32 -39.37 65.33 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.159 -0.473 . . . . 40.039999999999999 111.109 179.943 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -60.47 -52.58 64.58 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.258 -0.428 . . . . 71.040000000000006 110.886 -179.924 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.43 ' CD2' HD12 ' A' ' 32' ' ' LEU . 19.7 mt -55.27 -48.52 73.89 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.163 -0.471 . . . . 74.219999999999999 110.89 -179.956 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.407 HE22 ' ND2' ' A' ' 53' ' ' ASN . 0.0 OUTLIER -54.84 -41.94 71.33 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.196 -0.456 . . . . 40.020000000000003 110.894 179.977 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 51.0 t0 -57.99 -43.2 86.45 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.175 -0.466 . . . . 72.040000000000006 110.878 179.949 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 5.8 mtp -62.9 -55.36 26.75 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.205 -0.452 . . . . 72.329999999999998 110.873 179.989 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.512 HD12 HG23 ' A' ' 29' ' ' THR . 65.5 mt -53.24 -53.66 22.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.201 -0.454 . . . . 75.230000000000004 111.144 179.95 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . 0.407 ' ND2' HE22 ' A' ' 49' ' ' GLN . 6.5 m-20 -61.73 -37.67 85.06 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.203 -0.453 . . . . 71.219999999999999 110.88 179.936 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 -60.02 -33.16 71.64 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.163 -0.471 . . . . 72.310000000000002 110.914 179.986 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.489 HG11 ' SD ' ' A' ' 71' ' ' MET . 32.8 m -109.97 20.2 6.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.126 -0.488 . . . . 71.310000000000002 111.141 179.95 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 29.3 t0 -90.11 99.15 12.22 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.157 -0.474 . . . . 63.299999999999997 110.83 179.947 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.35 -40.19 13.76 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.163 -0.471 . . . . 63.43 111.071 179.956 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 13.0 p-10 -86.64 -0.12 55.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.235 -0.439 . . . . 74.420000000000002 110.859 179.981 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 52.46 56.81 15.8 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.738 -0.744 . . . . 71.209999999999994 112.504 -179.911 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 52.1 p-10 -114.48 -15.89 11.99 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.877 0.37 . . . . 71.120000000000005 110.921 -179.93 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . 0.498 ' O ' HG21 ' A' ' 52' ' ' ILE . . . 91.65 17.79 47.38 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.695 -0.764 . . . . 64.209999999999994 112.445 179.981 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 25.1 p -150.49 162.38 40.71 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.721 0.296 . . . . 75.239999999999995 111.168 -179.814 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.419 HG21 ' HD1' ' A' ' 68' ' ' PHE . 20.3 mt -97.86 109.39 23.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.242 -0.435 . . . . 74.109999999999999 111.121 179.941 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -75.84 -172.69 2.01 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.218 -0.447 . . . . 73.430000000000007 110.864 179.878 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.535 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 2.5 t80 -64.91 -58.15 13.77 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.644 0.735 . . . . 74.540000000000006 110.909 -179.948 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . 0.535 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 54.3 Cg_endo -69.71 -27.83 26.25 Favored 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.669 2.246 . . . . 51.32 112.364 179.977 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 14.0 mt-10 -59.75 -41.06 90.13 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.221 -0.445 . . . . 73.239999999999995 110.864 -179.939 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . 0.419 ' HD1' HG21 ' A' ' 63' ' ' ILE . 24.0 t80 -73.99 -36.11 64.49 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.164 -0.471 . . . . 63.310000000000002 110.924 -179.982 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 24.0 tp -68.14 -53.89 21.92 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.141 -0.481 . . . . 74.420000000000002 110.921 -179.987 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 14.8 t -54.92 -30.85 59.47 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.2 -0.455 . . . . 64.230000000000004 111.124 179.972 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . 0.489 ' SD ' HG11 ' A' ' 55' ' ' VAL . 44.1 ttp -58.94 -38.3 78.69 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.216 -0.447 . . . . 73.420000000000002 110.86 179.919 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -75.65 -36.66 60.09 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.214 -0.448 . . . . 63.140000000000001 110.884 179.965 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -60.14 -30.75 69.51 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.224 -0.444 . . . . 70.129999999999995 111.085 179.92 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 14.1 tpp180 -63.58 -19.88 65.19 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.248 -0.433 . . . . 65.319999999999993 110.912 -179.974 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -51.71 -32.09 28.85 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.197 -0.456 . . . . 71.219999999999999 110.859 -179.972 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -89.95 -25.04 21.11 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.197 -0.456 . . . . 73.030000000000001 110.9 179.895 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 52.6 mttt -71.29 -74.76 0.14 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.207 -0.451 . . . . 73.329999999999998 110.867 179.934 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -179.35 108.14 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.207 -0.451 . . . . 65.540000000000006 110.896 179.899 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -150.8 68.03 0.94 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.22 -0.446 . . . . 64.319999999999993 111.148 -179.864 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -117.46 -28.63 6.04 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.239 -0.437 . . . . 72.530000000000001 110.862 179.906 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 16.9 m -56.85 -27.64 60.59 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.215 -0.448 . . . . 54.439999999999998 110.838 -179.764 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -96.85 -26.53 15.06 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.141 -0.481 . . . . 74.030000000000001 110.879 -179.942 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 11.8 tm-20 -75.52 -34.19 60.78 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.163 -0.471 . . . . 75.25 110.866 -179.923 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 20.3 tp10 -66.71 -28.46 68.45 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.171 -0.468 . . . . 71.049999999999997 110.911 -179.94 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 76.5 mt -74.55 -48.71 33.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.128 -0.487 . . . . 55.340000000000003 111.11 179.98 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 25.9 ttt85 -71.44 -42.27 68.43 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.138 -0.483 . . . . 73.439999999999998 110.859 179.962 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.742 ' O ' HG23 ' A' ' 91' ' ' VAL . 18.0 tt0 -62.31 -56.93 13.67 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.215 -0.448 . . . . 61.140000000000001 110.89 -179.896 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . 0.469 ' HB1' ' CE2' ' A' ' 92' ' ' PHE . . . -53.35 -51.03 63.75 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.152 -0.476 . . . . 74.209999999999994 111.082 179.935 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 17.1 t80 -53.16 -43.41 67.03 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.2 -0.455 . . . . 73.140000000000001 110.933 -179.928 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 59.6 ttp180 -69.19 -34.29 74.69 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.127 -0.488 . . . . 72.129999999999995 110.846 -179.886 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . 0.742 HG23 ' O ' ' A' ' 87' ' ' GLU . 96.1 t -66.07 -40.73 88.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.139 -0.482 . . . . 74.099999999999994 111.167 179.967 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.469 ' CE2' ' HB1' ' A' ' 88' ' ' ALA . 8.3 m-85 -76.81 -31.92 57.27 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.129 -0.487 . . . . 75.129999999999995 110.843 -179.972 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 21.5 t0 -71.29 85.4 0.79 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.158 -0.473 . . . . 54.32 110.869 -180.0 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 11.5 ptpt -78.72 -40.58 33.25 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.175 -0.466 . . . . 74.329999999999998 110.876 -179.995 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 55.2 p-10 -75.01 -9.17 58.28 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.202 -0.454 . . . . 60.43 110.842 179.883 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 59.55 26.81 62.72 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.74 -0.743 . . . . 71.340000000000003 112.504 -179.885 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 35.8 p-10 -84.22 -16.13 44.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.879 0.371 . . . . 71.340000000000003 110.888 -179.901 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 80.98 18.26 70.25 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.744 -0.741 . . . . 70.549999999999997 112.482 -179.996 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 20.7 m-85 -140.83 142.24 34.61 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.84 0.352 . . . . 72.140000000000001 110.948 -179.789 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 62.3 mt -103.48 126.44 57.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.172 -0.467 . . . . 75.109999999999999 111.12 179.913 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 93.0 p -107.28 -175.63 2.84 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.193 -0.458 . . . . 70.400000000000006 110.896 -179.942 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . 0.66 ' O ' HG11 ' A' ' 121' ' ' VAL . . . -73.27 -31.56 64.16 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.115 -0.493 . . . . 74.209999999999994 111.088 179.928 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -71.07 -47.08 60.41 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.234 -0.439 . . . . 72.120000000000005 111.087 179.935 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . 0.43 ' O ' HG23 ' A' ' 108' ' ' VAL . 69.9 mt-10 -69.16 -44.02 73.12 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.254 -0.43 . . . . 75.510000000000005 110.917 -179.914 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 35.8 tp -53.42 -42.32 66.94 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.104 -0.498 . . . . 62.530000000000001 110.928 -179.989 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . 0.605 ' HB2' HG21 ' A' ' 121' ' ' VAL . 8.9 ttt-85 -63.98 -49.33 72.94 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.223 -0.444 . . . . 73.530000000000001 110.858 179.975 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 18.9 t60 -54.22 -34.39 60.52 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.212 -0.449 . . . . 61.350000000000001 110.877 179.951 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.43 HG23 ' O ' ' A' ' 104' ' ' GLU . 95.2 t -73.34 -29.98 29.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.194 -0.457 . . . . 71.209999999999994 111.098 179.995 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 44.4 tpp -73.29 -53.76 10.06 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.226 -0.443 . . . . 63.140000000000001 110.884 179.939 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 2.1 t -51.75 -30.18 21.66 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.198 -0.455 . . . . 75.439999999999998 111.13 -179.923 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 6.7 m120 -65.06 -37.45 87.6 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.2 -0.455 . . . . 55.43 110.932 179.979 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 17.3 mt -72.12 -9.72 58.8 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.182 -0.463 . . . . 62.130000000000003 110.916 179.919 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 101.08 29.18 6.53 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.736 -0.745 . . . . 74.439999999999998 112.503 179.923 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 12.4 tp10 -133.01 110.06 9.98 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.953 0.406 . . . . 72.439999999999998 110.885 -179.907 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 31.0 tttt -85.69 120.42 27.1 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.133 -0.485 . . . . 73.319999999999993 110.879 179.96 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.801 HD22 ' HG2' ' A' ' 120' ' ' GLU . 61.1 mt -124.54 153.58 41.9 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.191 -0.459 . . . . 74.319999999999993 110.921 179.895 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 45.5 p -89.55 162.83 15.47 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.18 -0.464 . . . . 65.219999999999999 111.154 179.964 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 94.7 m-20 -53.56 -38.78 64.19 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.206 -0.452 . . . . 41.409999999999997 110.882 179.935 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -68.23 -34.3 75.98 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.186 -0.461 . . . . 73.219999999999999 110.92 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . 0.801 ' HG2' HD22 ' A' ' 116' ' ' LEU . 19.9 tp10 -67.12 -42.3 84.75 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.117 -0.492 . . . . 73.219999999999999 110.902 -179.962 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.66 HG11 ' O ' ' A' ' 102' ' ' ALA . 63.6 t -60.34 -34.54 57.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.124 -0.489 . . . . 64.409999999999997 111.127 179.976 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -51.95 -46.95 64.95 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.199 -0.455 . . . . 63.130000000000003 110.837 179.92 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 35.2 tp10 -57.6 -29.26 64.36 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.214 -0.448 . . . . 75.299999999999997 110.867 -179.875 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 35.4 mtp -75.96 -58.06 3.5 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.162 -0.472 . . . . 73.049999999999997 110.862 -179.996 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 33.3 mm -54.0 -35.31 28.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.213 -0.449 . . . . 73.310000000000002 111.109 179.982 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 51.8 ttm-85 -69.01 -31.72 70.75 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.199 -0.455 . . . . 71.120000000000005 110.897 179.952 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -69.01 -40.5 78.65 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.134 -0.485 . . . . 72.549999999999997 110.888 -179.944 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.522 ' HB3' HG22 ' A' ' 136' ' ' VAL . . . -83.82 -27.34 28.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.133 -0.485 . . . . 73.329999999999998 111.105 179.946 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 50.7 t0 -74.54 86.6 2.09 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.21 -0.45 . . . . 73.340000000000003 110.881 179.944 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 90.1 mt -80.08 -45.57 22.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.239 -0.437 . . . . 61.409999999999997 111.152 179.966 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 16.6 p30 -71.43 -8.93 57.05 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.152 -0.476 . . . . 54.409999999999997 110.83 179.916 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 63.13 43.01 99.33 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.711 -0.756 . . . . 30.420000000000002 112.49 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 17.2 p-10 -88.9 -15.91 33.2 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.864 0.364 . . . . 73.299999999999997 110.826 -179.934 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 100.36 5.33 54.45 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.721 -0.752 . . . . 63.409999999999997 112.434 -179.966 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -149.33 172.16 15.35 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.821 0.343 . . . . 74.420000000000002 110.918 -179.823 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 136' ' ' VAL . . . . . 0.522 HG22 ' HB3' ' A' ' 128' ' ' ALA . 98.4 t -113.63 115.97 51.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.234 -0.439 . . . . 65.219999999999999 111.097 -179.991 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 45.9 p-10 -93.87 167.83 11.37 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.183 -0.462 . . . . 73.109999999999999 110.862 179.978 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . 0.709 ' O ' HG23 ' A' ' 142' ' ' VAL . 61.3 t80 -53.2 -41.94 65.8 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.159 -0.473 . . . . 75.129999999999995 110.948 -179.958 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 22.9 tp10 -57.11 -40.62 77.43 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.119 -0.491 . . . . 63.140000000000001 110.927 180.0 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -78.52 -29.94 46.79 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.088 -0.505 . . . . 75.099999999999994 110.859 -179.934 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 53.7 t80 -71.97 -37.1 69.97 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.184 -0.462 . . . . 74.450000000000003 110.918 -179.938 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . 0.709 HG23 ' O ' ' A' ' 138' ' ' TYR . 85.7 t -64.74 -44.94 96.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.12 -0.491 . . . . 62.119999999999997 111.165 179.929 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 42.2 tt0 -63.04 -27.97 69.77 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.161 -0.472 . . . . 63.219999999999999 110.906 -179.988 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 3.9 tpt -74.61 -54.96 6.45 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.183 -0.462 . . . . 75.010000000000005 110.859 180.0 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 12.8 ttm -65.54 -27.23 68.3 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.217 -0.447 . . . . 60.43 110.871 179.951 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 1.3 m -108.74 21.33 17.4 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.243 -0.435 . . . . 63.350000000000001 111.149 -179.916 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -51.65 143.08 13.21 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.184 -0.462 . . . . 73.540000000000006 111.075 179.857 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 29.8 ttmt . . . . . 0 C--N 1.328 -0.34 0 CA-C-N 116.238 -0.437 . . . . 72.109999999999999 110.926 179.956 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' M' M ' 8' ' ' LEU . . . . . . . . . . . . . 2.6 pp . . . . . 0 C--O 1.231 0.108 0 CA-C-O 120.831 0.348 . . . . 72.040000000000006 110.924 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' M' M ' 9' ' ' SER . . . . . . . . . . . . . 16.6 m -117.69 -64.26 1.32 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.185 -0.461 . . . . 65.019999999999996 110.898 -179.979 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' M' M ' 10' ' ' GLY . . . . . . . . . . . . . . . 165.73 64.87 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.759 -0.734 . . . . 60.420000000000002 112.546 -180.0 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' M' M ' 11' ' ' GLY . . . . . . . . . . . . . . . 97.08 30.03 7.67 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.714 -0.755 . . . . 63.240000000000002 112.493 -179.867 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' M' M ' 12' ' ' GLU . . . . . . . . . . . . . 21.2 mt-10 -98.37 171.77 7.97 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.875 0.369 . . . . 73.439999999999998 110.862 -179.853 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' M' M ' 13' ' ' LEU . . . . . 0.409 HD22 ' HA ' ' M' ' 13' ' ' LEU . 0.9 OUTLIER -88.21 75.82 8.54 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.132 -0.485 . . . . 75.540000000000006 110.894 -179.949 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' M' M ' 14' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -103.03 26.1 8.6 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.203 -0.453 . . . . 74.450000000000003 110.838 179.857 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' M' M ' 15' ' ' LYS . . . . . 0.455 ' CD ' HD11 ' A' ' 116' ' ' LEU . 16.2 mttm -68.77 -46.04 69.81 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.199 -0.455 . . . . 73.430000000000007 110.904 179.958 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' M' M ' 16' ' ' TRP . . . . . . . . . . . . . 34.3 m95 -52.06 -39.08 59.12 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.257 -0.428 . . . . 70.140000000000001 110.872 179.977 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' M' M ' 17' ' ' GLU . . . . . . . . . . . . . 17.2 tt0 -55.73 -34.2 64.94 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.255 -0.429 . . . . 71.319999999999993 110.89 -179.977 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' M' M ' 18' ' ' LYS . . . . . . . . . . . . . 6.3 ttmm -68.52 -22.18 64.53 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.198 -0.456 . . . . 75.230000000000004 110.862 -179.995 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' M' M ' 19' ' ' ILE . . . . . . . . . . . . . 24.2 mm -69.76 -33.61 57.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.192 -0.458 . . . . 50.0 111.119 179.868 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' M' M ' 20' ' ' ARG . . . . . . . . . . . . . 35.0 ttp180 -51.86 -30.3 23.21 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.194 -0.457 . . . . 73.219999999999999 110.871 179.978 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' M' M ' 21' ' ' LEU . . . . . . . . . . . . . 5.5 mt 55.57 -175.67 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.158 -0.473 . . . . 61.039999999999999 110.905 -179.995 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' M' M ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -109.43 155.45 41.2 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.589 0.709 . . . . 72.329999999999998 110.87 179.954 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' M' M ' 23' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.83 174.07 10.11 Favored 'Trans proline' 0 C--N 1.341 0.147 0 C-N-CA 122.68 2.253 . . . . 73.230000000000004 112.316 -179.98 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' M' M ' 24' ' ' GLY . . . . . . . . . . . . . . . 112.04 69.33 0.55 Allowed Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.707 -0.759 . . . . 51.340000000000003 112.486 -179.984 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' M' M ' 25' ' ' GLY . . . . . . . . . . . . . . . -159.07 -148.21 5.12 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.703 -0.761 . . . . 65.140000000000001 112.488 -179.961 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' M' M ' 26' ' ' LYS . . . . . . . . . . . . . 13.3 tptm -73.51 160.7 31.3 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.88 0.371 . . . . 73.319999999999993 110.862 -179.971 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' M' M ' 27' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.27 147.37 31.53 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.191 -0.459 . . . . 65.129999999999995 110.933 179.856 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' M' M ' 28' ' ' GLN . . . . . . . . . . . . . 7.6 tp60 -176.58 126.18 0.18 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.238 -0.437 . . . . 74.049999999999997 110.925 -179.995 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' M' M ' 29' ' ' TYR . . . . . 0.472 ' CE1' HG12 ' A' ' 55' ' ' VAL . 5.0 t80 -63.48 -71.59 0.16 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.214 -0.448 . . . . 61.409999999999997 110.962 -179.877 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' M' M ' 30' ' ' LYS . . . . . . . . . . . . . 9.2 tttt 173.38 -46.44 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.114 -0.494 . . . . 64.319999999999993 110.88 179.869 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' M' M ' 31' ' ' LEU . . . . . 0.723 ' CD1' HD12 ' M' ' 34' ' ' ILE . 8.1 tp -96.47 -36.19 10.88 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.279 -0.418 . . . . 74.140000000000001 110.914 179.959 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' M' M ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -47.41 -34.4 7.11 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.139 -0.482 . . . . 63.240000000000002 110.886 179.855 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' M' M ' 33' ' ' HIS . . . . . . . . . . . . . 3.4 t60 -52.02 -45.78 64.72 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.212 -0.449 . . . . 74.230000000000004 110.868 179.926 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' M' M ' 34' ' ' ILE . . . . . 0.723 HD12 ' CD1' ' M' ' 31' ' ' LEU . 60.8 mt -51.82 -35.32 17.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.142 -0.481 . . . . 74.049999999999997 111.136 179.97 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' M' M ' 35' ' ' VAL . . . . . . . . . . . . . 46.2 t -49.95 -39.58 15.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.194 -0.457 . . . . 75.409999999999997 111.143 179.865 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' M' M ' 36' ' ' TRP . . . . . . . . . . . . . 18.3 m0 -58.79 -39.48 81.18 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.14 -0.482 . . . . 75.239999999999995 110.976 179.907 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' M' M ' 37' ' ' ALA . . . . . 1.0 ' HB3' HD13 ' A' ' 39' ' ' LEU . . . -63.85 -18.52 64.24 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.229 -0.441 . . . . 22.109999999999999 111.102 179.859 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' M' M ' 38' ' ' SER . . . . . . . . . . . . . 1.4 m -68.75 -17.81 64.11 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.242 -0.435 . . . . 62.030000000000001 110.842 -179.765 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' M' M ' 39' ' ' ARG . . . . . . . . . . . . . 51.3 mtp85 -51.73 -29.97 20.62 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.136 -0.484 . . . . 50.43 110.884 -179.968 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' M' M ' 40' ' ' GLU . . . . . . . . . . . . . 28.7 mm-40 -80.07 -47.28 15.09 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.192 -0.458 . . . . 74.319999999999993 110.908 -179.939 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' M' M ' 41' ' ' LEU . . . . . 0.587 HD21 ' OG ' ' A' ' 38' ' ' SER . 8.3 mt -61.01 176.62 0.4 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.108 -0.496 . . . . 61.039999999999999 110.932 -179.984 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' M' M ' 42' ' ' GLU . . . . . . . . . . . . . 16.5 tt0 -171.78 161.92 6.06 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.231 -0.44 . . . . 72.310000000000002 110.881 179.93 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' M' M ' 43' ' ' ARG . . . . . . . . . . . . . 11.0 mmm180 . . . . . 0 C--N 1.329 -0.3 0 CA-C-N 116.137 -0.483 . . . . 73.219999999999999 110.851 -179.887 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 241' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 262' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 301' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 322' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.146 0 CA-C-O 120.782 0.325 . . . . 54.439999999999998 111.05 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 4.0 p-10 -60.49 -38.46 84.39 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.287 -0.415 . . . . 71.25 110.837 179.999 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 69.21 -75.53 0.07 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.173 -0.467 . . . . 72.129999999999995 110.942 -179.891 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.633 HD22 ' HG2' ' A' ' 8' ' ' GLN . 9.1 mt -111.0 170.13 8.31 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.204 -0.453 . . . . 53.420000000000002 110.915 -179.998 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.64 ' O ' HD12 ' A' ' 9' ' ' ILE . 50.1 p -117.28 171.91 7.65 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.198 -0.456 . . . . 54.140000000000001 111.102 179.959 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 31.5 tt0 -53.63 -33.8 56.36 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.194 -0.457 . . . . 74.519999999999996 110.886 179.958 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 27.4 tt0 -60.77 -27.97 68.39 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.184 -0.462 . . . . 54.240000000000002 110.933 -179.963 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . 0.633 ' HG2' HD22 ' A' ' 4' ' ' LEU . 8.2 tp-100 -78.02 -43.46 29.39 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.134 -0.485 . . . . 74.319999999999993 110.932 -179.975 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . 0.64 HD12 ' O ' ' A' ' 5' ' ' THR . 4.4 mp -71.41 -38.64 69.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.217 -0.447 . . . . 71.25 111.134 179.957 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -53.42 -40.13 64.88 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.154 -0.476 . . . . 75.450000000000003 111.127 179.795 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -74.65 -50.48 17.57 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.17 -0.468 . . . . 62.109999999999999 110.884 -179.927 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.591 ' CB ' HD13 ' A' ' 69' ' ' LEU . 16.5 m-85 -55.89 -37.62 69.08 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.16 -0.473 . . . . 62.009999999999998 110.904 -179.926 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 26.1 tttm -54.63 -37.27 65.43 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.155 -0.475 . . . . 75.310000000000002 110.935 179.916 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -68.24 -34.18 75.76 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.239 -0.437 . . . . 74.010000000000005 110.889 179.997 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -67.68 -28.21 67.49 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.141 -0.481 . . . . 32.530000000000001 111.082 179.934 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 91.0 t80 -75.64 -54.22 7.33 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.251 -0.432 . . . . 73.319999999999993 110.863 -179.897 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 9.4 t -54.32 -27.57 36.59 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.209 -0.451 . . . . 72.310000000000002 110.812 -179.769 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 16.3 tp -65.18 -38.87 91.89 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.179 -0.464 . . . . 71.129999999999995 110.928 -179.992 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.686 ' CD1' HG11 ' A' ' 35' ' ' VAL . 19.8 m-85 -81.46 -24.76 36.59 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.198 -0.455 . . . . 71.239999999999995 110.911 179.932 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 11.7 t0 -83.35 98.6 9.55 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.139 -0.482 . . . . 65.120000000000005 110.788 179.996 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 21.1 mmmt -67.27 -50.96 58.4 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.16 -0.473 . . . . 74.209999999999994 110.907 179.933 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 22.2 p-10 -80.93 -10.16 59.75 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.217 -0.447 . . . . 70.109999999999999 110.893 179.86 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 51.64 42.3 51.64 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.746 -0.74 . . . . 74.319999999999993 112.481 -179.969 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 34.1 p-10 -88.25 -15.15 36.64 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.838 0.351 . . . . 75.329999999999998 110.858 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 105.4 -11.18 47.13 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.711 -0.756 . . . . 33.549999999999997 112.502 -179.924 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 7.3 p -127.97 130.75 48.9 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.791 0.329 . . . . 71.5 111.162 -179.882 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.661 HG22 ' HB2' ' A' ' 32' ' ' LEU . 22.0 mt -104.29 109.79 28.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.222 -0.444 . . . . 64.209999999999994 111.127 179.913 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.739 HG22 ' CG2' ' A' ' 62' ' ' THR . 20.1 p -95.47 -176.88 3.9 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.173 -0.467 . . . . 43.310000000000002 111.144 179.964 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.46 HG22 ' CD1' ' A' ' 52' ' ' ILE . 69.5 p -66.11 -27.45 68.06 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.21 -0.45 . . . . 64.200000000000003 111.168 -179.99 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.07 -49.99 17.9 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.172 -0.467 . . . . 62.409999999999997 110.928 179.885 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.704 ' O ' HG23 ' A' ' 35' ' ' VAL . 23.8 mt-10 -70.61 -40.15 73.34 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.198 -0.455 . . . . 71.430000000000007 110.863 179.967 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.661 ' HB2' HG22 ' A' ' 27' ' ' ILE . 3.8 tt -74.31 -49.69 21.93 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.195 -0.457 . . . . 75.230000000000004 110.857 -179.914 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -54.63 -31.5 52.99 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.731 -0.747 . . . . 63.140000000000001 112.509 179.905 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 96.3 m -73.38 -47.04 45.33 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.814 0.34 . . . . 64.019999999999996 111.125 -179.856 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.704 HG23 ' O ' ' A' ' 31' ' ' GLU . 51.7 t -54.54 -54.34 23.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.229 -0.441 . . . . 75.239999999999995 111.151 179.892 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . 0.524 ' HA ' HD12 ' A' ' 39' ' ' LEU . 8.2 ptm -65.72 -36.73 84.44 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.136 -0.484 . . . . 54.420000000000002 110.872 179.932 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 52.4 ttt85 -54.31 -37.31 64.68 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.244 -0.434 . . . . 53.5 110.921 -179.962 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . 0.585 ' OG ' HD11 ' M' ' 41' ' ' LEU . 0.9 OUTLIER -70.04 -23.63 63.13 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.2 -0.455 . . . . 74.329999999999998 110.883 -179.816 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.956 HD13 ' HB3' ' M' ' 37' ' ' ALA . 18.3 mt -85.59 -10.72 55.45 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.121 -0.491 . . . . 73.549999999999997 110.919 179.978 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 101.78 22.49 10.14 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.772 -0.728 . . . . 73.030000000000001 112.482 179.871 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 3.8 mp0 -121.22 96.81 5.24 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.787 0.327 . . . . 74.140000000000001 110.935 -179.891 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 52.5 t30 -109.89 79.34 1.45 Allowed Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.63 0.729 . . . . 71.349999999999994 110.908 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.79 168.21 22.25 Favored 'Trans proline' 0 C--O 1.232 0.205 0 C-N-CA 122.685 2.256 . . . . 71.120000000000005 112.344 179.964 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 24.7 p -79.22 159.9 27.13 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.224 -0.444 . . . . 63.219999999999999 111.146 -179.969 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -51.66 -45.72 63.49 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.197 -0.456 . . . . 73.439999999999998 110.88 -179.958 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -68.42 -31.39 70.7 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.142 -0.481 . . . . 72.030000000000001 111.081 179.969 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 76.9 tt0 -69.7 -44.81 69.65 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.261 -0.427 . . . . 73.109999999999999 110.834 -179.922 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 27.3 mt -56.35 -51.88 66.65 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.165 -0.471 . . . . 70.409999999999997 110.913 -179.958 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 24.2 tp60 -66.1 -28.03 68.51 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.183 -0.462 . . . . 75.140000000000001 110.879 179.958 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 23.4 t0 -56.26 -49.66 73.57 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.183 -0.462 . . . . 60.229999999999997 110.845 -179.977 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . 0.42 ' HE2' ' HB3' ' M' ' 31' ' ' LEU . 8.0 ptp -74.07 -36.91 64.36 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.216 -0.447 . . . . 72.129999999999995 110.934 179.953 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.46 ' CD1' HG22 ' A' ' 29' ' ' THR . 91.1 mt -62.55 -38.27 81.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.218 -0.446 . . . . 71.019999999999996 111.128 179.966 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 15.1 m-20 -66.61 -24.66 66.35 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.181 -0.463 . . . . 73.329999999999998 110.891 179.952 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -76.22 -26.53 56.18 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.129 -0.487 . . . . 71.409999999999997 110.875 179.978 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.538 HG13 ' CE1' ' M' ' 29' ' ' TYR . 4.4 m -108.41 8.39 9.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.202 -0.454 . . . . 64.25 111.161 179.956 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 30.8 t0 -82.99 98.39 9.23 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.15 -0.477 . . . . 74.409999999999997 110.84 179.936 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.28 -43.02 11.87 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.203 -0.453 . . . . 51.439999999999998 111.067 179.961 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 43.5 p30 -84.26 -0.12 51.08 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.191 -0.459 . . . . 70.209999999999994 110.882 179.974 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 54.84 54.8 31.13 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.756 -0.735 . . . . 53.310000000000002 112.497 -179.933 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 49.7 p-10 -114.56 -15.67 11.97 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.875 0.369 . . . . 75.230000000000004 110.893 -179.869 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 94.16 18.56 36.21 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.744 -0.741 . . . . 53.130000000000003 112.527 179.994 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . 0.739 ' CG2' HG22 ' A' ' 28' ' ' THR . 20.4 p -145.62 175.52 10.3 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.776 0.322 . . . . 73.400000000000006 111.082 -179.844 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.447 HG21 ' HD1' ' A' ' 68' ' ' PHE . 18.9 mt -108.75 110.6 32.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.194 -0.457 . . . . 73.450000000000003 111.132 179.922 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.0 t0 -76.02 -172.93 2.15 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.199 -0.455 . . . . 64.230000000000004 110.862 179.9 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.521 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 2.4 t80 -64.76 -58.19 13.96 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-O 121.675 0.75 . . . . 61.329999999999998 110.893 -179.878 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . 0.521 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 54.0 Cg_endo -69.72 -26.8 27.41 Favored 'Trans proline' 0 C--N 1.342 0.208 0 C-N-CA 122.696 2.264 . . . . 65.310000000000002 112.331 179.972 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 63.0 mt-10 -61.59 -40.46 94.85 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.232 -0.44 . . . . 71.150000000000006 110.918 -179.976 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . 0.447 ' HD1' HG21 ' A' ' 63' ' ' ILE . 25.1 t80 -74.44 -35.83 63.37 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.163 -0.471 . . . . 53.43 110.86 -179.93 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.591 HD13 ' CB ' ' A' ' 12' ' ' PHE . 35.3 tp -69.61 -54.06 15.79 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.107 -0.497 . . . . 53.329999999999998 110.914 -179.94 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 14.6 t -52.82 -30.38 33.07 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.182 -0.463 . . . . 62.119999999999997 111.151 179.966 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . 0.481 ' HE1' HD11 ' M' ' 31' ' ' LEU . 39.2 ttp -60.4 -51.23 70.36 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.197 -0.456 . . . . 71.439999999999998 110.88 179.91 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 5.2 mmt -70.24 -46.03 65.28 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.244 -0.434 . . . . 71.109999999999999 110.906 179.956 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -54.62 -32.54 59.08 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.228 -0.442 . . . . 73.340000000000003 111.093 179.912 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 24.3 ttm180 -60.46 -25.8 66.28 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.219 -0.446 . . . . 73.209999999999994 110.873 -179.897 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 2.7 tmtm? -58.38 -28.33 65.06 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.188 -0.46 . . . . 73.120000000000005 110.864 179.985 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . 0.487 ' SD ' HD21 ' A' ' 4' ' ' LEU . 38.7 mtm -53.28 -41.56 65.69 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.208 -0.451 . . . . 65.200000000000003 110.889 179.829 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -157.11 139.15 14.44 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.239 -0.437 . . . . 71.400000000000006 110.88 179.982 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 -173.81 -177.62 1.42 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.235 -0.439 . . . . 75.099999999999994 110.873 179.848 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 1.9 t -152.36 74.53 1.08 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.198 -0.456 . . . . 62.140000000000001 111.094 -179.867 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -112.7 -26.37 8.64 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.251 -0.431 . . . . 53.340000000000003 110.889 179.896 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 1.7 p -52.19 -52.55 51.45 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.167 -0.47 . . . . 74.209999999999994 110.846 -179.741 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -72.87 -27.21 61.77 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.11 -0.495 . . . . 71.329999999999998 110.919 -179.96 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 18.3 tt0 -66.18 -36.15 82.34 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.097 -0.502 . . . . 70.140000000000001 110.896 -179.929 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -62.08 -36.36 81.45 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.167 -0.469 . . . . 73.040000000000006 110.874 -179.935 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.609 HD13 HG13 ' A' ' 142' ' ' VAL . 68.8 mt -75.1 -50.98 22.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.123 -0.489 . . . . 72.450000000000003 111.104 -179.975 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 34.9 ttm180 -63.41 -28.23 69.84 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.2 -0.455 . . . . 73.25 110.855 179.957 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.719 ' O ' HG23 ' A' ' 91' ' ' VAL . 2.3 mm-40 -63.8 -50.91 67.12 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.245 -0.434 . . . . 62.229999999999997 110.84 -179.889 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -66.13 -44.02 85.41 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.195 -0.457 . . . . 75.019999999999996 111.1 179.962 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 5.7 t80 -51.97 -48.02 64.55 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.184 -0.462 . . . . 64.010000000000005 110.863 -179.921 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 4.3 ttt-85 -63.78 -39.9 95.38 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.157 -0.474 . . . . 72.439999999999998 110.864 -179.911 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . 0.719 HG23 ' O ' ' A' ' 87' ' ' GLU . 90.4 t -59.37 -33.53 51.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.213 -0.448 . . . . 72.129999999999995 111.142 179.982 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.551 ' CE1' HG11 ' A' ' 108' ' ' VAL . 8.6 m-85 -89.98 -26.19 20.49 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.191 -0.458 . . . . 63.310000000000002 110.89 -179.986 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 17.1 t0 -73.97 95.6 2.52 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.16 -0.473 . . . . 60.119999999999997 110.834 -179.999 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 13.5 mtpt -78.67 -53.25 7.35 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.224 -0.444 . . . . 74.409999999999997 110.922 179.963 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 48.9 p30 -73.55 -9.15 58.38 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.239 -0.437 . . . . 73.310000000000002 110.909 179.841 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 60.35 31.54 74.26 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.724 -0.75 . . . . 64.540000000000006 112.494 -179.92 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 45.6 p-10 -86.24 -16.2 38.42 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.856 0.36 . . . . 75.209999999999994 110.879 -179.891 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 89.91 18.73 49.98 Favored Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.69 -0.767 . . . . 62.350000000000001 112.492 -179.975 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 14.1 m-85 -134.58 155.68 50.02 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.921 0.391 . . . . 73.120000000000005 110.912 -179.839 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 68.5 mt -122.77 121.44 63.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.136 -0.484 . . . . 72.109999999999999 111.11 179.957 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 59.7 p -114.59 176.53 5.01 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.172 -0.467 . . . . 70.349999999999994 110.872 -179.899 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . 0.532 ' HB1' ' CG1' ' A' ' 121' ' ' VAL . . . -66.08 -24.95 66.81 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.133 -0.485 . . . . 71.510000000000005 111.113 179.909 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -71.81 -49.91 34.39 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.164 -0.471 . . . . 44.439999999999998 111.108 179.949 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -76.63 -47.77 21.21 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.213 -0.449 . . . . 74.340000000000003 110.855 -179.877 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.858 HD21 ' HE2' ' A' ' 124' ' ' MET . 23.5 tp -52.95 -50.75 63.43 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.183 -0.462 . . . . 64.439999999999998 110.909 -179.974 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . 0.484 ' O ' HG23 ' A' ' 110' ' ' THR . 64.2 ttt-85 -52.32 -37.81 56.91 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.199 -0.455 . . . . 73.340000000000003 110.897 179.942 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 43.6 t60 -58.93 -34.4 71.7 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.14 -0.482 . . . . 72.239999999999995 110.873 179.982 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.551 HG11 ' CE1' ' A' ' 92' ' ' PHE . 21.7 t -74.47 -49.12 32.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.217 -0.447 . . . . 71.010000000000005 111.123 179.955 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . 0.758 ' HA ' HD12 ' A' ' 112' ' ' LEU . 3.9 mmt -64.91 -27.16 68.66 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.185 -0.461 . . . . 74.420000000000002 110.894 179.921 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . 0.484 HG23 ' O ' ' A' ' 106' ' ' ARG . 18.9 p -75.32 -48.3 23.77 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.238 -0.437 . . . . 71.430000000000007 111.164 -179.944 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 12.2 t30 -56.61 -26.62 56.13 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.241 -0.436 . . . . 75.310000000000002 110.889 179.967 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.758 HD12 ' HA ' ' A' ' 109' ' ' MET . 6.6 mt -70.72 -22.52 62.43 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.184 -0.462 . . . . 72.540000000000006 110.92 179.958 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 101.09 33.09 5.06 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.771 -0.728 . . . . 50.149999999999999 112.444 179.882 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 24.7 mm-40 -122.28 109.97 15.11 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.899 0.38 . . . . 74.219999999999999 110.871 -179.89 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . 0.512 ' O ' HD23 ' A' ' 116' ' ' LEU . 28.0 tptt -65.44 137.1 57.23 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.188 -0.46 . . . . 72.430000000000007 110.874 179.99 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.583 HD22 ' HG2' ' A' ' 120' ' ' GLU . 48.2 mt -145.76 150.71 36.73 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.209 -0.45 . . . . 65.019999999999996 110.914 179.929 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . 0.714 ' O ' HG23 ' A' ' 121' ' ' VAL . 73.2 p -100.49 170.05 8.65 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.219 -0.446 . . . . 74.140000000000001 111.145 179.96 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -53.06 -44.61 67.6 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.25 -0.432 . . . . 74.319999999999993 110.845 179.891 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 -70.38 -45.44 66.04 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.239 -0.437 . . . . 74.209999999999994 110.884 -179.891 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . 0.583 ' HG2' HD22 ' A' ' 116' ' ' LEU . 5.7 tp10 -55.08 -32.18 61.77 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.185 -0.461 . . . . 64.510000000000005 110.898 -179.948 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.714 HG23 ' O ' ' A' ' 117' ' ' THR . 73.9 t -69.59 -30.85 46.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.206 -0.452 . . . . 71.439999999999998 111.143 179.964 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -78.49 -28.52 46.36 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.12 -0.491 . . . . 72.140000000000001 110.878 179.9 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -55.74 -50.01 71.55 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.172 -0.467 . . . . 54.020000000000003 110.876 -179.867 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . 0.858 ' HE2' HD21 ' A' ' 105' ' ' LEU . 12.4 ptm -66.72 -44.31 81.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.167 -0.47 . . . . 71.420000000000002 110.929 179.911 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 28.4 mm -53.94 -35.43 28.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.216 -0.447 . . . . 63.0 111.153 179.956 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 23.0 ttp180 -66.8 -31.78 72.63 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.16 -0.473 . . . . 73.140000000000001 110.844 179.95 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 10.1 tm-20 -68.83 -40.0 79.68 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.187 -0.461 . . . . 75.420000000000002 110.857 -179.928 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.657 ' HB3' HG22 ' A' ' 136' ' ' VAL . . . -82.57 -29.6 30.17 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.178 -0.464 . . . . 63.200000000000003 111.105 179.951 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 43.3 t0 -68.39 86.91 0.29 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.23 -0.441 . . . . 73.230000000000004 110.915 179.949 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 81.3 mt -79.69 -48.42 20.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.173 -0.467 . . . . 55.329999999999998 111.16 -179.955 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 18.7 p30 -73.01 -8.6 56.45 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.157 -0.474 . . . . 72.120000000000005 110.835 179.846 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 63.49 43.05 98.72 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.739 -0.743 . . . . 43.240000000000002 112.517 -179.915 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 25.8 p-10 -89.53 -15.8 32.13 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.868 0.366 . . . . 65.329999999999998 110.856 -179.909 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 102.96 3.51 48.73 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.723 -0.751 . . . . 70.200000000000003 112.484 179.993 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -149.14 172.11 15.34 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.852 0.358 . . . . 72.340000000000003 110.905 -179.84 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 136' ' ' VAL . . . . . 0.657 HG22 ' HB3' ' A' ' 128' ' ' ALA . 82.7 t -107.67 109.18 27.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.211 -0.45 . . . . 61.310000000000002 111.149 179.937 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 20.8 p30 -92.04 164.76 13.49 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.183 -0.462 . . . . 74.019999999999996 110.888 -179.978 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . 0.614 ' O ' HG23 ' A' ' 142' ' ' VAL . 15.5 t80 -52.3 -45.73 65.66 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.172 -0.467 . . . . 73.439999999999998 110.909 -179.868 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -52.01 -40.07 60.42 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.155 -0.475 . . . . 75.239999999999995 110.864 -179.986 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 24.2 mt-10 -78.42 -48.47 15.38 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.223 -0.444 . . . . 70.109999999999999 110.856 -179.928 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 47.6 t80 -54.17 -40.55 67.59 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.123 -0.489 . . . . 74.140000000000001 110.878 -179.916 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . 0.614 HG23 ' O ' ' A' ' 138' ' ' TYR . 92.6 t -69.23 -38.77 78.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.138 -0.483 . . . . 73.519999999999996 111.145 179.981 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 50.8 tt0 -68.66 -41.23 79.63 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.153 -0.476 . . . . 73.420000000000002 110.943 -179.992 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -74.73 -51.81 13.24 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.198 -0.455 . . . . 63.119999999999997 110.857 179.979 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 32.9 tpp -51.92 -30.11 22.95 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.209 -0.451 . . . . 54.219999999999999 110.929 179.901 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 89.6 m -92.58 -27.56 17.28 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.236 -0.438 . . . . 65.25 111.133 -179.95 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -56.3 140.65 44.31 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.251 -0.431 . . . . 34.130000000000003 111.102 179.839 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 11.0 tptm . . . . . 0 C--N 1.328 -0.34 0 CA-C-N 116.21 -0.45 . . . . 75.349999999999994 110.874 179.993 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' M' M ' 8' ' ' LEU . . . . . . . . . . . . . 11.4 mt . . . . . 0 C--O 1.231 0.086 0 CA-C-O 120.867 0.365 . . . . 63.200000000000003 110.946 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' M' M ' 9' ' ' SER . . . . . . . . . . . . . 10.3 t -133.01 174.57 10.22 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.172 -0.467 . . . . 73.040000000000006 110.869 -179.93 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' M' M ' 10' ' ' GLY . . . . . . . . . . . . . . . -155.94 -108.18 0.28 Allowed Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.718 -0.754 . . . . 33.350000000000001 112.457 -179.96 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' M' M ' 11' ' ' GLY . . . . . . . . . . . . . . . 111.89 -129.69 9.24 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.734 -0.746 . . . . 72.109999999999999 112.498 -179.897 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' M' M ' 12' ' ' GLU . . . . . . . . . . . . . 16.8 mm-40 -64.18 -169.96 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.882 0.372 . . . . 55.539999999999999 110.865 -179.895 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' M' M ' 13' ' ' LEU . . . . . 0.402 HD22 ' HA ' ' M' ' 13' ' ' LEU . 1.0 OUTLIER -76.23 77.52 3.03 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.133 -0.485 . . . . 70.010000000000005 110.912 179.97 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' M' M ' 14' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -98.98 15.43 25.77 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.18 -0.464 . . . . 72.349999999999994 110.865 179.829 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' M' M ' 15' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.99 -42.05 70.16 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.204 -0.453 . . . . 73.299999999999997 110.873 -179.993 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' M' M ' 16' ' ' TRP . . . . . 0.401 ' CZ3' HD12 ' M' ' 19' ' ' ILE . 32.2 m95 -56.59 -28.13 59.61 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.228 -0.442 . . . . 74.219999999999999 110.887 179.947 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' M' M ' 17' ' ' GLU . . . . . . . . . . . . . 9.5 tt0 -54.04 -30.26 47.1 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.267 -0.424 . . . . 73.430000000000007 110.916 -179.992 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' M' M ' 18' ' ' LYS . . . . . 0.564 ' CD ' HD13 ' A' ' 112' ' ' LEU . 2.3 ttmp? -60.77 -25.96 66.89 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.132 -0.485 . . . . 62.43 110.878 179.969 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' M' M ' 19' ' ' ILE . . . . . 0.401 HD12 ' CZ3' ' M' ' 16' ' ' TRP . 29.4 mt -103.5 -42.06 7.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.245 -0.434 . . . . 74.349999999999994 111.161 179.866 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' M' M ' 20' ' ' ARG . . . . . . . . . . . . . 46.0 ttp180 -66.69 -22.23 66.08 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.174 -0.466 . . . . 65.450000000000003 110.839 -179.969 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' M' M ' 21' ' ' LEU . . . . . . . . . . . . . 5.9 mt 63.42 160.64 0.09 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.167 -0.47 . . . . 61.210000000000001 110.935 -179.945 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' M' M ' 22' ' ' ARG . . . . . . . . . . . . . 50.8 ttm-85 -78.57 136.83 59.34 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.614 0.721 . . . . 74.150000000000006 110.853 179.96 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' M' M ' 23' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.83 93.15 0.52 Allowed 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.69 2.26 . . . . 72.439999999999998 112.295 -179.98 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' M' M ' 24' ' ' GLY . . . . . . . . . . . . . . . -148.48 52.5 0.54 Allowed Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.71 -0.757 . . . . 73.209999999999994 112.458 179.948 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' M' M ' 25' ' ' GLY . . . . . . . . . . . . . . . 169.5 84.77 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.746 -0.74 . . . . 71.209999999999994 112.462 -179.938 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' M' M ' 26' ' ' LYS . . . . . . . . . . . . . 25.5 mtpp -97.86 29.97 3.2 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.819 0.342 . . . . 73.239999999999995 110.889 -179.98 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' M' M ' 27' ' ' LYS . . . . . . . . . . . . . 8.0 tttm -148.88 145.19 27.34 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.232 -0.44 . . . . 73.329999999999998 110.868 179.888 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' M' M ' 28' ' ' GLN . . . . . . . . . . . . . 7.9 pt20 -56.87 163.75 1.83 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.181 -0.463 . . . . 71.430000000000007 110.927 179.943 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' M' M ' 29' ' ' TYR . . . . . 0.538 ' CE1' HG13 ' A' ' 55' ' ' VAL . 47.0 m-85 57.56 179.1 0.05 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.191 -0.459 . . . . 73.120000000000005 110.938 -179.878 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' M' M ' 30' ' ' LYS . . . . . . . . . . . . . 5.4 ttmm -144.24 15.05 1.66 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.153 -0.476 . . . . 53.439999999999998 110.903 179.885 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' M' M ' 31' ' ' LEU . . . . . 0.481 HD11 ' HE1' ' A' ' 71' ' ' MET . 0.8 OUTLIER -118.52 -28.93 5.58 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.195 -0.457 . . . . 64.409999999999997 110.908 179.918 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' M' M ' 32' ' ' LYS . . . . . . . . . . . . . 1.8 mttp -48.9 -44.44 40.16 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.184 -0.462 . . . . 45.229999999999997 110.875 179.823 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' M' M ' 33' ' ' HIS . . . . . . . . . . . . . 56.5 t-80 -50.26 -39.78 46.05 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.212 -0.449 . . . . 71.219999999999999 110.908 179.903 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' M' M ' 34' ' ' ILE . . . . . . . . . . . . . 29.2 mt -50.31 -39.86 17.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.182 -0.463 . . . . 72.200000000000003 111.137 179.974 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' M' M ' 35' ' ' VAL . . . . . . . . . . . . . 61.2 t -48.81 -40.71 12.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.204 -0.453 . . . . 55.299999999999997 111.096 179.844 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' M' M ' 36' ' ' TRP . . . . . . . . . . . . . 21.4 m0 -59.2 -39.74 83.57 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.214 -0.448 . . . . 74.299999999999997 110.916 -179.995 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' M' M ' 37' ' ' ALA . . . . . 0.956 ' HB3' HD13 ' A' ' 39' ' ' LEU . . . -63.21 -18.7 63.8 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.226 -0.443 . . . . 73.420000000000002 111.089 179.858 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' M' M ' 38' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -66.29 -18.03 65.11 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.259 -0.428 . . . . 75.209999999999994 110.857 -179.792 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' M' M ' 39' ' ' ARG . . . . . . . . . . . . . 12.5 ptt180 -55.62 -25.74 40.45 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.109 -0.496 . . . . 74.349999999999994 110.866 -179.946 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' M' M ' 40' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -91.3 -47.97 7.18 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.203 -0.453 . . . . 65.409999999999997 110.894 -179.931 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' M' M ' 41' ' ' LEU . . . . . 0.585 HD11 ' OG ' ' A' ' 38' ' ' SER . 10.8 mt -67.41 130.42 43.01 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.182 -0.463 . . . . 71.049999999999997 110.88 -179.97 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' M' M ' 42' ' ' GLU . . . . . . . . . . . . . 22.9 tp10 -93.72 -28.46 15.94 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.228 -0.442 . . . . 73.450000000000003 110.887 179.921 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' M' M ' 43' ' ' ARG . . . . . . . . . . . . . 10.2 mpt_? . . . . . 0 C--N 1.329 -0.293 0 CA-C-N 116.111 -0.495 . . . . 73.540000000000006 110.87 -179.899 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 241' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 262' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 301' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 322' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.131 0 CA-C-O 120.761 0.315 . . . . 72.140000000000001 111.079 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 12.2 t0 56.59 29.62 15.89 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.237 -0.438 . . . . 75.409999999999997 110.858 -179.986 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 46.8 tt0 -144.99 142.74 30.06 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.188 -0.46 . . . . 73.209999999999994 110.928 -179.943 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.473 HD22 ' NE2' ' A' ' 8' ' ' GLN . 9.3 mt -82.29 136.85 34.97 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.174 -0.466 . . . . 70.25 110.893 -179.97 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.726 ' O ' HD12 ' A' ' 9' ' ' ILE . 1.4 p -89.38 170.19 10.75 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.176 -0.466 . . . . 74.400000000000006 111.141 179.982 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 6.6 tm-20 -53.31 -41.31 65.55 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.233 -0.44 . . . . 73.209999999999994 110.876 -179.994 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -63.55 -26.7 68.82 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.143 -0.48 . . . . 72.209999999999994 110.899 -179.922 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . 0.473 ' NE2' HD22 ' A' ' 4' ' ' LEU . 13.8 tt0 -76.9 -54.54 6.45 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.151 -0.477 . . . . 75.400000000000006 110.896 -179.939 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . 0.726 HD12 ' O ' ' A' ' 5' ' ' THR . 3.3 mp -65.96 -50.35 70.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.232 -0.44 . . . . 74.230000000000004 111.133 179.973 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -56.02 -25.47 44.68 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.189 -0.46 . . . . 71.450000000000003 111.12 179.812 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 14.2 tp10 -75.17 -38.39 60.91 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.206 -0.452 . . . . 72.140000000000001 110.856 -179.948 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.45 ' CB ' HD13 ' A' ' 69' ' ' LEU . 54.2 m-85 -76.28 -46.13 29.32 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.175 -0.466 . . . . 73.420000000000002 110.911 -179.908 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 7.8 ptmm? -57.25 -29.39 63.77 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.183 -0.462 . . . . 70.409999999999997 110.919 179.945 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -66.82 -37.54 84.72 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.194 -0.457 . . . . 74.040000000000006 110.889 179.939 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -67.03 -37.17 83.64 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.159 -0.473 . . . . 71.409999999999997 111.089 179.934 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 77.4 t80 -59.45 -54.31 48.14 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.227 -0.442 . . . . 64.540000000000006 110.878 -179.895 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 41.5 t -56.3 -28.13 57.77 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.118 -0.492 . . . . 71.329999999999998 110.833 -179.767 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 15.5 tp -65.5 -40.79 93.47 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.138 -0.483 . . . . 73.430000000000007 110.894 -179.985 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.55 ' HA ' HG21 ' A' ' 35' ' ' VAL . 43.1 m-85 -80.49 -24.67 39.26 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.2 -0.454 . . . . 61.210000000000001 110.858 179.973 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 9.8 t0 -79.44 98.61 6.85 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.165 -0.471 . . . . 75.0 110.849 179.998 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.68 -47.06 82.74 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.193 -0.458 . . . . 64.5 110.816 -179.966 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 24.4 p-10 -86.89 -10.21 53.89 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.246 -0.434 . . . . 72.25 110.905 179.894 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 51.41 46.23 52.63 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.728 -0.749 . . . . 75.0 112.49 -179.953 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 29.5 p-10 -88.73 -14.06 38.13 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.843 0.354 . . . . 72.549999999999997 110.89 -179.984 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 105.35 13.41 24.66 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.788 -0.72 . . . . 53.539999999999999 112.491 -179.95 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 1.4 p -154.65 142.26 19.82 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.772 0.32 . . . . 54.140000000000001 111.108 -179.872 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 25.1 mt -101.84 124.99 56.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.209 -0.45 . . . . 75.099999999999994 111.102 179.943 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.552 HG22 ' CG2' ' A' ' 62' ' ' THR . 39.5 p -110.05 174.83 5.68 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.188 -0.46 . . . . 71.239999999999995 111.141 179.929 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.737 HG22 HD12 ' A' ' 52' ' ' ILE . 61.0 p -61.07 -31.89 71.54 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.178 -0.464 . . . . 72.5 111.134 179.993 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.84 -49.93 12.11 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.224 -0.444 . . . . 71.099999999999994 110.906 179.937 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 23.3 mt-10 -61.26 -33.62 73.84 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.211 -0.45 . . . . 63.539999999999999 110.908 179.958 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.1 tt -74.24 -55.11 6.43 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.12 -0.491 . . . . 71.239999999999995 110.926 -179.994 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -52.22 -27.87 24.98 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.747 -0.74 . . . . 73.420000000000002 112.461 179.948 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 54.8 m -63.69 -59.18 4.92 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.797 0.332 . . . . 73.219999999999999 111.12 -179.861 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.55 HG21 ' HA ' ' A' ' 19' ' ' PHE . 36.3 t -52.62 -49.29 45.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.208 -0.451 . . . . 73.209999999999994 111.09 179.957 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 28.2 mtp -51.83 -35.79 45.75 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.186 -0.461 . . . . 55.43 110.907 179.904 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 24.5 ttp180 -55.73 -51.88 65.84 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.199 -0.455 . . . . 74.120000000000005 110.891 -179.942 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . 0.636 ' OG ' HD21 ' M' ' 41' ' ' LEU . 3.8 t -66.45 -28.5 68.65 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.179 -0.464 . . . . 75.120000000000005 110.87 -179.816 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.963 HD13 ' HB3' ' M' ' 37' ' ' ALA . 57.6 mt -77.14 -24.3 51.62 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.111 -0.495 . . . . 72.400000000000006 110.924 179.963 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 101.35 32.8 5.08 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.756 -0.735 . . . . 54.020000000000003 112.477 179.89 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 17.6 mm-40 -131.09 105.42 7.7 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.853 0.358 . . . . 65.010000000000005 110.897 -179.874 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 59.9 t30 -109.86 76.93 1.01 Allowed Pre-proline 0 C--N 1.33 -0.282 0 CA-C-O 121.619 0.723 . . . . 71.439999999999998 110.878 -179.948 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.83 168.01 22.88 Favored 'Trans proline' 0 C--O 1.231 0.162 0 C-N-CA 122.67 2.247 . . . . 62.32 112.315 179.965 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 76.7 p -86.95 157.53 19.47 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.209 -0.45 . . . . 72.430000000000007 111.14 -179.958 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -52.28 -39.22 60.17 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.233 -0.44 . . . . 74.340000000000003 110.88 179.984 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -72.13 -32.96 67.41 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.203 -0.453 . . . . 64.219999999999999 111.092 179.946 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 10.1 tt0 -69.7 -49.71 50.79 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.191 -0.458 . . . . 75.219999999999999 110.886 -179.916 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 34.1 mt -55.14 -43.08 73.84 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.163 -0.471 . . . . 50.530000000000001 110.885 -179.955 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 19.4 tp60 -56.42 -33.63 66.01 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.151 -0.477 . . . . 64.340000000000003 110.895 179.951 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -70.18 -37.52 75.16 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.233 -0.439 . . . . 72.299999999999997 110.863 179.988 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 39.6 mtp -65.22 -57.84 7.49 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.204 -0.453 . . . . 72.329999999999998 110.88 -179.994 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.737 HD12 HG22 ' A' ' 29' ' ' THR . 62.4 mt -57.61 -42.64 81.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.21 -0.45 . . . . 55.240000000000002 111.167 179.96 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 48.6 m-20 -59.28 -37.19 77.03 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.146 -0.479 . . . . 72.409999999999997 110.842 179.936 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -65.69 -29.87 70.48 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.209 -0.451 . . . . 73.230000000000004 110.88 -179.993 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 14.7 m -103.15 6.64 10.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.144 -0.48 . . . . 75.400000000000006 111.142 179.979 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 31.3 t0 -90.11 96.63 10.76 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.125 -0.489 . . . . 74.040000000000006 110.869 179.927 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.18 -42.0 12.61 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.184 -0.462 . . . . 70.030000000000001 111.118 179.956 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -85.02 0.01 52.9 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.234 -0.439 . . . . 43.299999999999997 110.849 179.99 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 55.03 57.98 15.81 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.754 -0.736 . . . . 74.340000000000003 112.519 -179.924 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 52.2 p-10 -114.6 -15.7 11.95 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.871 0.367 . . . . 72.439999999999998 110.92 -179.917 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 90.06 16.91 55.18 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.738 -0.744 . . . . 63.130000000000003 112.446 179.917 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . 0.552 ' CG2' HG22 ' A' ' 28' ' ' THR . 46.9 p -151.35 162.85 40.2 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.735 0.302 . . . . 73.099999999999994 111.158 -179.846 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 19.9 mt -96.94 116.99 40.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.184 -0.462 . . . . 74.140000000000001 111.124 179.921 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.4 t0 -81.12 -172.95 4.02 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.199 -0.455 . . . . 74.0 110.864 179.865 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.519 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 2.5 t80 -64.93 -58.4 12.96 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.64 0.733 . . . . 74.540000000000006 110.92 -179.932 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . 0.519 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 54.1 Cg_endo -69.76 -28.73 24.89 Favored 'Trans proline' 0 C--N 1.341 0.158 0 C-N-CA 122.681 2.254 . . . . 72.319999999999993 112.379 179.937 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 23.8 mt-10 -58.24 -45.45 87.73 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.218 -0.447 . . . . 63.340000000000003 110.88 179.992 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 13.2 t80 -71.37 -36.43 71.44 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.149 -0.478 . . . . 72.439999999999998 110.892 -179.948 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.45 HD13 ' CB ' ' A' ' 12' ' ' PHE . 15.3 tp -64.09 -53.7 45.63 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.169 -0.469 . . . . 74.040000000000006 110.922 -179.972 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 14.8 t -61.26 -29.46 69.86 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.189 -0.46 . . . . 75.219999999999999 111.153 179.94 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 5.6 tmm? -63.31 -43.83 96.72 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.223 -0.444 . . . . 74.530000000000001 110.885 179.902 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -79.49 -30.01 41.85 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.223 -0.444 . . . . 73.310000000000002 110.864 179.984 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -74.88 -28.5 60.67 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.238 -0.437 . . . . 71.349999999999994 111.09 179.924 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 44.2 ttm-85 -66.25 -19.09 65.72 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.216 -0.447 . . . . 73.239999999999995 110.902 -179.909 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 18.5 pttm -51.44 -30.79 20.72 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.176 -0.466 . . . . 72.010000000000005 110.888 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 14.8 ttt -52.36 -31.21 32.55 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.198 -0.455 . . . . 62.119999999999997 110.86 179.906 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 25.5 mtpp -153.11 121.14 6.13 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.277 -0.42 . . . . 74.430000000000007 110.919 179.94 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -158.95 176.73 11.95 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.241 -0.436 . . . . 74.510000000000005 110.838 179.87 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 6.6 p -52.13 158.64 1.07 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.147 -0.479 . . . . 45.439999999999998 111.175 -179.907 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 14.2 p-10 -138.16 -44.22 0.51 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.247 -0.433 . . . . 73.25 110.871 179.927 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 71.0 m -58.37 -51.59 69.18 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.178 -0.465 . . . . 74.019999999999996 110.808 -179.731 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 27.9 tt0 -52.62 -57.97 8.3 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.152 -0.476 . . . . 70.519999999999996 110.912 -179.922 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -56.41 -42.32 77.8 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.172 -0.467 . . . . 72.430000000000007 110.913 179.983 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -54.73 -35.48 63.75 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.148 -0.478 . . . . 62.340000000000003 110.854 -179.908 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.94 HG21 HG22 ' A' ' 142' ' ' VAL . 49.8 mt -74.77 -36.39 39.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.175 -0.466 . . . . 74.549999999999997 111.135 179.994 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 2.2 tpm_? -70.78 -53.58 14.91 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.15 -0.477 . . . . 74.409999999999997 110.855 179.974 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.722 ' O ' HG23 ' A' ' 91' ' ' VAL . 1.6 pp20? -60.44 -39.87 89.06 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.18 -0.463 . . . . 65.450000000000003 110.894 -179.933 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -59.58 -48.51 81.39 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.148 -0.478 . . . . 51.229999999999997 111.086 179.946 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 9.1 t80 -52.08 -44.93 64.59 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.27 -0.423 . . . . 74.239999999999995 110.841 -179.87 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 6.5 tpt180 -66.38 -40.77 89.9 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.178 -0.464 . . . . 73.150000000000006 110.858 -179.91 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . 0.722 HG23 ' O ' ' A' ' 87' ' ' GLU . 92.4 t -58.4 -33.85 48.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.202 -0.454 . . . . 71.420000000000002 111.153 179.981 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 9.9 m-85 -87.52 -36.86 17.37 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.161 -0.472 . . . . 72.150000000000006 110.874 -180.0 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 17.6 t0 -61.3 96.05 0.05 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.151 -0.477 . . . . 64.239999999999995 110.847 -179.979 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 7.2 mtmp? -78.63 -52.55 8.28 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.16 -0.473 . . . . 74.209999999999994 110.924 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 32.7 p30 -75.45 -9.14 58.31 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.253 -0.431 . . . . 73.510000000000005 110.872 179.855 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 60.61 31.9 76.55 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.758 -0.734 . . . . 64.209999999999994 112.46 -179.972 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 48.6 p-10 -83.13 -16.1 48.09 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.879 0.371 . . . . 73.519999999999996 110.909 -179.931 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 86.72 18.7 57.9 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.77 -0.728 . . . . 73.510000000000005 112.489 179.99 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 6.4 m-85 -137.52 147.89 45.56 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.851 0.358 . . . . 64.109999999999999 110.942 -179.853 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 62.3 mt -112.7 112.9 42.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.117 -0.492 . . . . 74.129999999999995 111.111 179.919 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 52.0 p -107.05 -174.23 2.48 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.139 -0.482 . . . . 72.049999999999997 110.847 -179.915 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . 0.539 ' HB1' ' CG1' ' A' ' 121' ' ' VAL . . . -67.71 -32.25 72.76 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.112 -0.495 . . . . 71.209999999999994 111.086 179.927 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -69.88 -45.33 67.91 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.18 -0.464 . . . . 72.129999999999995 111.098 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 18.4 mt-10 -75.32 -51.24 13.66 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.197 -0.456 . . . . 72.030000000000001 110.89 -179.942 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 47.2 tp -53.48 -43.28 68.05 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.157 -0.474 . . . . 63.020000000000003 110.925 -179.982 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 56.1 ttp180 -56.21 -49.39 74.22 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.224 -0.444 . . . . 71.319999999999993 110.903 179.931 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 80.0 t60 -54.44 -34.92 62.36 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.21 -0.45 . . . . 75.519999999999996 110.841 -179.995 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 81.0 t -67.02 -46.2 85.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.201 -0.454 . . . . 75.0 111.16 179.93 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . 0.403 ' HE1' ' HB2' ' M' ' 15' ' ' LYS . 3.3 mmt -69.47 -25.14 63.93 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.133 -0.485 . . . . 63.439999999999998 110.885 179.923 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 7.4 m -74.12 -56.26 5.13 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.185 -0.461 . . . . 71.099999999999994 111.132 -179.891 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 6.4 t-20 -56.75 -26.79 58.21 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.234 -0.439 . . . . 73.209999999999994 110.849 -179.984 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 19.3 mt -70.74 -22.25 62.44 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.178 -0.464 . . . . 73.340000000000003 110.914 179.987 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 101.09 33.02 5.08 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.757 -0.735 . . . . 71.420000000000002 112.467 179.859 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 24.7 tp10 -110.25 163.24 13.83 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.928 0.394 . . . . 73.120000000000005 110.901 -179.889 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . 0.493 ' O ' HD23 ' A' ' 116' ' ' LEU . 48.0 mttp -116.92 103.57 10.42 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.19 -0.459 . . . . 74.010000000000005 110.904 179.958 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.621 HD22 ' HG2' ' A' ' 120' ' ' GLU . 17.9 mt -131.25 113.22 13.55 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.183 -0.462 . . . . 73.310000000000002 110.9 179.932 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 34.3 p -72.04 172.72 9.56 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.169 -0.469 . . . . 73.439999999999998 111.133 179.951 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 69.1 m-20 -51.91 -38.14 55.13 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.184 -0.462 . . . . 73.439999999999998 110.895 179.908 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 50.4 tp10 -71.7 -35.99 70.41 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.189 -0.46 . . . . 74.140000000000001 110.891 -179.901 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . 0.621 ' HG2' HD22 ' A' ' 116' ' ' LEU . 2.0 tt0 -63.55 -40.0 95.87 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.153 -0.476 . . . . 74.310000000000002 110.872 -179.93 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.539 ' CG1' ' HB1' ' A' ' 102' ' ' ALA . 60.1 t -62.72 -43.68 98.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.179 -0.464 . . . . 72.329999999999998 111.107 -179.965 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 39.8 t0 -57.06 -55.13 38.7 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.19 -0.459 . . . . 64.150000000000006 110.851 179.906 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 10.9 tm-20 -56.25 -29.28 60.86 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.157 -0.474 . . . . 72.040000000000006 110.887 -179.893 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . 0.462 ' HE1' HD11 ' M' ' 19' ' ' ILE . 24.6 ttt -68.01 -59.95 2.87 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.146 -0.479 . . . . 64.329999999999998 110.853 -179.965 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.501 HG23 HG23 ' A' ' 136' ' ' VAL . 31.4 mm -53.98 -35.78 29.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.235 -0.439 . . . . 72.420000000000002 111.092 179.98 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 31.6 ttp180 -61.12 -31.73 71.42 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.2 -0.454 . . . . 64.420000000000002 110.914 179.949 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 11.8 tm-20 -72.23 -46.27 56.76 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.185 -0.461 . . . . 75.349999999999994 110.881 -179.943 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.642 ' HB3' HG22 ' A' ' 136' ' ' VAL . . . -73.37 -25.52 60.62 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.173 -0.467 . . . . 70.519999999999996 111.101 179.938 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 38.8 t0 -68.07 87.34 0.27 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.205 -0.452 . . . . 73.129999999999995 110.878 179.975 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 70.5 mt -79.91 -48.12 20.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.195 -0.457 . . . . 62.200000000000003 111.151 179.988 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 18.9 p30 -75.1 -8.65 57.14 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.183 -0.462 . . . . 75.430000000000007 110.847 179.869 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 63.99 45.18 94.64 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.742 -0.742 . . . . 54.130000000000003 112.522 -179.884 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 35.3 p-10 -92.21 -15.84 27.01 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.867 0.365 . . . . 74.549999999999997 110.882 -179.977 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 103.46 2.83 47.36 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.772 -0.728 . . . . 33.210000000000001 112.522 -179.931 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -149.22 172.23 15.18 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.871 0.367 . . . . 75.230000000000004 110.952 -179.926 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 136' ' ' VAL . . . . . 0.642 HG22 ' HB3' ' A' ' 128' ' ' ALA . 49.1 t -108.49 113.25 43.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.21 -0.45 . . . . 45.549999999999997 111.132 179.98 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 16.3 p30 -93.17 172.1 8.52 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.159 -0.473 . . . . 75.040000000000006 110.924 179.997 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 88.6 t80 -54.91 -47.33 74.49 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.212 -0.449 . . . . 74.430000000000007 110.962 -179.922 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 25.1 tt0 -51.96 -49.72 62.63 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.094 -0.503 . . . . 74.340000000000003 110.886 -179.979 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 14.7 mt-10 -66.46 -32.68 74.2 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.18 -0.464 . . . . 70.340000000000003 110.825 -179.88 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 37.5 t80 -66.33 -45.32 80.64 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.177 -0.465 . . . . 64.329999999999998 110.926 -179.952 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . 0.94 HG22 HG21 ' A' ' 85' ' ' ILE . 66.8 t -69.53 -39.64 78.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.101 -0.499 . . . . 64.340000000000003 111.113 179.962 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 30.6 tt0 -62.28 -57.83 9.96 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.2 -0.455 . . . . 61.25 110.856 -179.964 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 11.6 tpt -56.57 -30.73 63.48 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.256 -0.429 . . . . 72.349999999999994 110.882 179.966 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 145' ' ' MET . . . . . 0.486 ' HE1' HG22 ' M' ' 19' ' ' ILE . 5.6 ttm -75.87 -37.22 59.13 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.219 -0.446 . . . . 64.439999999999998 110.935 179.934 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 1.9 m -97.54 21.19 10.59 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.16 -0.473 . . . . 55.240000000000002 111.158 -179.927 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -117.94 142.01 47.81 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.185 -0.462 . . . . 33.399999999999999 111.115 179.851 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 39.6 tttp . . . . . 0 C--N 1.329 -0.292 0 CA-C-N 116.205 -0.452 . . . . 72.340000000000003 110.94 179.964 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' M' M ' 8' ' ' LEU . . . . . . . . . . . . . 8.8 mp . . . . . 0 C--O 1.231 0.093 0 CA-C-O 120.853 0.358 . . . . 71.219999999999999 110.904 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' M' M ' 9' ' ' SER . . . . . . . . . . . . . 7.2 m 56.78 50.77 11.91 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.182 -0.463 . . . . 74.219999999999999 110.814 -179.923 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' M' M ' 10' ' ' GLY . . . . . . . . . . . . . . . 55.1 -153.54 11.58 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.756 -0.735 . . . . 74.230000000000004 112.444 179.97 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' M' M ' 11' ' ' GLY . . . . . . . . . . . . . . . -101.37 93.21 1.11 Allowed Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.709 -0.757 . . . . 70.209999999999994 112.453 -179.852 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' M' M ' 12' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -138.73 -171.57 3.11 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.896 0.379 . . . . 65.409999999999997 110.91 -179.911 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' M' M ' 13' ' ' LEU . . . . . 0.403 ' C ' HD13 ' M' ' 13' ' ' LEU . 2.1 tm? -72.27 83.51 1.04 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.178 -0.465 . . . . 74.209999999999994 110.934 -179.976 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' M' M ' 14' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -114.47 -15.91 11.99 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.209 -0.451 . . . . 74.109999999999999 110.853 179.889 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' M' M ' 15' ' ' LYS . . . . . 0.403 ' HB2' ' HE1' ' A' ' 109' ' ' MET . 0.2 OUTLIER -51.56 -46.62 63.49 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.185 -0.461 . . . . 73.409999999999997 110.914 179.989 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' M' M ' 16' ' ' TRP . . . . . 0.509 ' CZ2' ' HB2' ' A' ' 128' ' ' ALA . 6.1 m95 -58.1 -37.16 73.99 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.246 -0.434 . . . . 72.239999999999995 110.957 179.917 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' M' M ' 17' ' ' GLU . . . . . . . . . . . . . 11.9 tt0 -60.27 -22.06 62.64 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.24 -0.436 . . . . 74.049999999999997 110.911 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' M' M ' 18' ' ' LYS . . . . . . . . . . . . . 19.9 ttpp -65.31 -24.79 67.37 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.137 -0.483 . . . . 75.310000000000002 110.896 179.941 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' M' M ' 19' ' ' ILE . . . . . 0.486 HG22 ' HE1' ' A' ' 145' ' ' MET . 33.1 mt -97.09 -23.14 4.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.219 -0.446 . . . . 65.430000000000007 111.088 179.927 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' M' M ' 20' ' ' ARG . . . . . . . . . . . . . 37.1 ttp85 -52.62 -36.01 55.68 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.17 -0.468 . . . . 55.240000000000002 110.87 179.986 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' M' M ' 21' ' ' LEU . . . . . . . . . . . . . 3.9 mt 59.03 -174.02 0.1 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.216 -0.447 . . . . 73.010000000000005 110.903 -179.998 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' M' M ' 22' ' ' ARG . . . . . 0.488 ' CB ' ' CD ' ' M' ' 23' ' ' PRO . 0.3 OUTLIER -179.32 -61.86 0.0 OUTLIER Pre-proline 0 C--N 1.33 -0.276 0 CA-C-O 121.662 0.744 . . . . 73.340000000000003 110.902 179.941 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' M' M ' 23' ' ' PRO . . . . . 0.488 ' CD ' ' CB ' ' M' ' 22' ' ' ARG . 53.5 Cg_endo -69.79 91.99 0.52 Allowed 'Trans proline' 0 C--N 1.342 0.199 0 C-N-CA 122.675 2.25 . . . . 72.140000000000001 112.284 -179.982 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' M' M ' 24' ' ' GLY . . . . . . . . . . . . . . . -114.54 -135.11 5.89 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.704 -0.76 . . . . 64.049999999999997 112.476 179.939 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' M' M ' 25' ' ' GLY . . . . . . . . . . . . . . . 150.09 -19.35 1.08 Allowed Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.754 -0.736 . . . . 21.219999999999999 112.489 -179.881 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' M' M ' 26' ' ' LYS . . . . . . . . . . . . . 7.9 mtpp -56.18 175.96 0.09 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.901 0.381 . . . . 75.329999999999998 110.852 -179.986 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' M' M ' 27' ' ' LYS . . . . . . . . . . . . . 6.9 ptpt -177.22 142.38 0.35 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.183 -0.462 . . . . 64.299999999999997 110.925 179.846 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' M' M ' 28' ' ' GLN . . . . . . . . . . . . . 79.5 mm-40 -150.97 165.59 33.25 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.202 -0.454 . . . . 62.450000000000003 110.895 179.999 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' M' M ' 29' ' ' TYR . . . . . . . . . . . . . 2.1 t80 -118.48 -11.01 10.01 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.212 -0.449 . . . . 73.200000000000003 110.933 -179.894 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' M' M ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 63.68 26.26 14.5 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.113 -0.494 . . . . 74.25 110.878 179.938 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' M' M ' 31' ' ' LEU . . . . . . . . . . . . . 11.8 tp -157.59 -49.89 0.07 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.259 -0.428 . . . . 65.219999999999999 110.928 179.902 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' M' M ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.43 -35.89 41.41 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.21 -0.45 . . . . 73.129999999999995 110.882 179.826 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' M' M ' 33' ' ' HIS . . . . . . . . . . . . . 13.0 t-80 -50.86 -38.72 50.96 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.189 -0.46 . . . . 44.219999999999999 110.853 179.908 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' M' M ' 34' ' ' ILE . . . . . . . . . . . . . 49.5 mm -50.03 -38.7 14.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.243 -0.435 . . . . 74.450000000000003 111.153 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' M' M ' 35' ' ' VAL . . . . . . . . . . . . . 40.9 t -50.17 -40.17 17.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.182 -0.463 . . . . 74.030000000000001 111.142 179.854 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' M' M ' 36' ' ' TRP . . . . . . . . . . . . . 20.9 m0 -59.66 -36.57 76.68 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.19 -0.459 . . . . 61.420000000000002 110.893 179.977 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' M' M ' 37' ' ' ALA . . . . . 0.963 ' HB3' HD13 ' A' ' 39' ' ' LEU . . . -63.62 -18.83 64.33 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.239 -0.437 . . . . 74.200000000000003 111.076 179.901 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' M' M ' 38' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -73.67 -17.94 61.08 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.208 -0.451 . . . . 74.310000000000002 110.858 -179.754 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' M' M ' 39' ' ' ARG . . . . . . . . . . . . . 14.2 ttt180 -55.0 -26.58 37.92 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.1 -0.5 . . . . 64.230000000000004 110.888 -179.976 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' M' M ' 40' ' ' GLU . . . . . . . . . . . . . 3.5 pt-20 -84.58 -32.21 23.91 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.166 -0.47 . . . . 74.349999999999994 110.868 -179.896 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' M' M ' 41' ' ' LEU . . . . . 0.636 HD21 ' OG ' ' A' ' 38' ' ' SER . 11.2 mt -74.93 174.24 9.55 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.146 -0.479 . . . . 73.150000000000006 110.929 -179.985 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' M' M ' 42' ' ' GLU . . . . . . . . . . . . . 46.3 tt0 -172.16 77.98 0.05 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.231 -0.44 . . . . 75.129999999999995 110.882 179.975 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' M' M ' 43' ' ' ARG . . . . . . . . . . . . . 6.0 ptp85 . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 116.167 -0.469 . . . . 72.310000000000002 110.835 -179.887 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 241' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 262' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 301' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 322' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.09 0 CA-C-O 120.811 0.339 . . . . 72.040000000000006 111.079 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -111.44 -66.63 1.06 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.214 -0.448 . . . . 64.140000000000001 110.856 -179.993 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 25.3 pt20 -118.69 177.26 4.9 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.183 -0.462 . . . . 63.200000000000003 110.908 -179.911 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.507 HD13 ' CD ' ' A' ' 8' ' ' GLN . 3.9 mm? -114.95 109.33 17.96 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.195 -0.457 . . . . 71.310000000000002 110.925 179.981 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 77.7 p -102.39 176.3 5.23 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.198 -0.455 . . . . 73.439999999999998 111.137 179.971 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -57.27 -33.98 68.18 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.251 -0.431 . . . . 75.400000000000006 110.862 -179.959 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 84.7 tt0 -68.07 -38.3 82.25 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.175 -0.466 . . . . 62.420000000000002 110.894 -179.935 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . 0.507 ' CD ' HD13 ' A' ' 4' ' ' LEU . 47.8 tt0 -78.01 -37.37 47.26 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.159 -0.473 . . . . 72.310000000000002 110.922 -179.956 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 52.8 mt -72.9 -40.93 60.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.183 -0.462 . . . . 63.200000000000003 111.145 179.983 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.41 -28.15 69.58 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.124 -0.489 . . . . 73.150000000000006 111.144 179.756 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 19.5 mm-40 -74.93 -52.14 11.97 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.214 -0.448 . . . . 61.130000000000003 110.88 -179.909 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 26.3 m-85 -66.89 -45.99 76.28 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.156 -0.475 . . . . 73.120000000000005 110.88 -179.919 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -52.92 -46.17 67.95 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.143 -0.48 . . . . 72.5 110.931 179.948 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -54.93 -30.84 59.54 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.188 -0.46 . . . . 73.230000000000004 110.868 -179.997 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -69.52 -45.29 69.18 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.172 -0.467 . . . . 64.049999999999997 111.08 179.933 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 85.5 t80 -54.75 -54.26 44.31 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.191 -0.459 . . . . 75.329999999999998 110.903 -179.906 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 10.6 t -61.58 -26.38 67.93 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.15 -0.477 . . . . 61.119999999999997 110.902 -179.806 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 2.9 tt -65.31 -40.03 93.23 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.104 -0.498 . . . . 72.439999999999998 110.911 -179.994 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.664 ' CD1' HG11 ' A' ' 35' ' ' VAL . 36.1 m-85 -77.6 -34.62 53.39 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.147 -0.478 . . . . 54.109999999999999 110.881 179.965 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 15.9 t0 -67.21 98.57 0.62 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.134 -0.484 . . . . 61.240000000000002 110.892 179.998 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 23.3 mmtp -72.06 -56.46 5.58 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.226 -0.443 . . . . 70.129999999999995 110.893 -179.994 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 17.1 p-10 -71.01 -10.24 59.4 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.19 -0.459 . . . . 72.010000000000005 110.877 179.859 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 51.54 71.21 0.69 Allowed Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.751 -0.738 . . . . 75.230000000000004 112.438 -179.997 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 22.7 p-10 -114.52 -15.75 11.99 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.874 0.368 . . . . 72.420000000000002 110.884 179.995 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 101.21 12.37 36.48 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.718 -0.753 . . . . 50.119999999999997 112.484 -179.926 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 1.9 p -154.66 144.47 21.62 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.743 0.306 . . . . 73.319999999999993 111.133 -179.853 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 22.2 mt -102.93 114.46 42.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.237 -0.438 . . . . 71.219999999999999 111.109 179.934 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.782 HG22 HG21 ' A' ' 62' ' ' THR . 19.2 p -102.06 174.91 5.72 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.146 -0.479 . . . . 74.329999999999998 111.172 179.945 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.473 HG22 HD12 ' A' ' 52' ' ' ILE . 69.9 p -61.0 -29.97 70.01 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.198 -0.455 . . . . 63.130000000000003 111.149 -179.979 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 32.3 mtmt -79.89 -50.12 10.93 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.258 -0.428 . . . . 71.239999999999995 110.841 179.96 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.415 ' OE1' HG23 ' A' ' 28' ' ' THR . 50.8 mt-10 -63.34 -35.91 81.95 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.234 -0.439 . . . . 73.319999999999993 110.919 179.981 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.0 tt -74.25 -52.2 13.06 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.121 -0.49 . . . . 70.439999999999998 110.927 179.983 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -52.17 -29.2 28.48 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.782 -0.723 . . . . 52.219999999999999 112.477 179.928 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 95.5 m -66.07 -58.91 4.42 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.853 0.359 . . . . 64.299999999999997 111.125 -179.828 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.664 HG11 ' CD1' ' A' ' 19' ' ' PHE . 94.2 t -54.39 -45.95 69.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.216 -0.447 . . . . 72.140000000000001 111.141 179.902 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 1.9 mmm -52.18 -38.24 57.2 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.198 -0.455 . . . . 73.209999999999994 110.858 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 3.8 tmt_? -55.55 -52.74 62.72 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.214 -0.448 . . . . 63.130000000000003 110.921 -179.95 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . 0.673 ' OG ' HD21 ' M' ' 41' ' ' LEU . 5.9 t -59.89 -29.74 68.53 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.184 -0.462 . . . . 73.120000000000005 110.889 -179.813 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 1.03 HD13 ' HB3' ' M' ' 37' ' ' ALA . 48.2 mt -80.26 -21.46 42.72 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.099 -0.5 . . . . 74.040000000000006 110.93 179.957 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 101.46 31.02 5.68 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.754 -0.736 . . . . 53.240000000000002 112.448 179.868 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -127.4 113.45 16.24 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.814 0.34 . . . . 73.530000000000001 110.917 -179.924 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 32.3 t-20 -109.87 81.22 1.95 Allowed Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.628 0.728 . . . . 73.329999999999998 110.857 -179.96 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.72 167.95 22.92 Favored 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.673 2.249 . . . . 73.510000000000005 112.395 179.887 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 20.2 p -98.44 157.46 16.2 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.239 -0.437 . . . . 63.329999999999998 111.153 -179.97 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -52.02 -45.19 64.49 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.245 -0.434 . . . . 74.540000000000006 110.834 -179.952 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.555 ' HB3' ' HB2' ' A' ' 139' ' ' GLU . . . -71.07 -31.65 68.1 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.209 -0.45 . . . . 73.310000000000002 111.124 179.914 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -66.67 -49.19 66.94 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.206 -0.452 . . . . 60.310000000000002 110.871 -179.914 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 16.3 mt -55.17 -50.65 68.77 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.142 -0.481 . . . . 73.430000000000007 110.936 -179.96 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 24.6 tp60 -60.19 -28.6 68.1 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.155 -0.475 . . . . 43.109999999999999 110.947 179.919 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 45.4 t0 -74.18 -49.8 21.97 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.19 -0.459 . . . . 71.340000000000003 110.87 -179.99 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . 0.543 ' CE ' HD13 ' M' ' 31' ' ' LEU . 15.6 ptm -66.95 -41.65 86.58 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.153 -0.476 . . . . 62.219999999999999 110.926 179.974 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.473 HD12 HG22 ' A' ' 29' ' ' THR . 96.9 mt -66.76 -37.95 80.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.204 -0.453 . . . . 74.299999999999997 111.15 179.931 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 37.9 m-20 -63.2 -24.9 68.09 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.143 -0.48 . . . . 60.340000000000003 110.842 179.982 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 15.9 mm-40 -73.09 -41.2 64.33 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.194 -0.457 . . . . 74.209999999999994 110.886 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 32.6 m -86.37 -17.5 9.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.134 -0.485 . . . . 73.340000000000003 111.138 179.991 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 39.0 t0 -66.84 94.1 0.3 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.146 -0.479 . . . . 74.549999999999997 110.825 179.978 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.3 -29.79 20.11 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.183 -0.462 . . . . 63.43 111.037 179.974 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -92.86 -0.19 57.29 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.256 -0.429 . . . . 70.150000000000006 110.874 -179.976 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 52.18 60.11 8.07 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.739 -0.743 . . . . 51.310000000000002 112.498 -179.922 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 44.8 p-10 -114.43 -15.88 12.01 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.896 0.379 . . . . 64.409999999999997 110.902 -179.911 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 96.22 8.34 57.77 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.724 -0.75 . . . . 72.209999999999994 112.436 179.947 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . 0.782 HG21 HG22 ' A' ' 28' ' ' THR . 71.9 p -150.61 175.11 12.24 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.772 0.32 . . . . 61.420000000000002 111.131 -179.853 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 19.3 mt -101.67 115.6 43.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.204 -0.453 . . . . 65.129999999999995 111.146 179.874 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 27.4 m-20 -78.46 -172.88 3.08 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.155 -0.475 . . . . 61.310000000000002 110.905 179.837 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.529 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 2.5 t80 -64.83 -58.37 13.28 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 121.632 0.73 . . . . 74.230000000000004 110.847 -179.838 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . 0.529 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 54.1 Cg_endo -69.75 -31.01 21.41 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.674 2.249 . . . . 74.310000000000002 112.34 -179.997 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 19.9 mt-10 -57.45 -41.86 81.37 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.2 -0.455 . . . . 73.519999999999996 110.863 -179.942 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 10.6 t80 -73.93 -36.07 64.65 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.174 -0.467 . . . . 73.230000000000004 110.908 -179.921 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 16.8 tp -66.68 -53.92 28.67 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.146 -0.479 . . . . 74.5 110.878 -179.986 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 15.3 t -56.21 -31.23 63.3 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.2 -0.455 . . . . 74.310000000000002 111.117 179.962 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 41.4 ttp -60.05 -50.37 73.99 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.237 -0.438 . . . . 73.439999999999998 110.848 179.95 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . 0.45 ' HE2' HG21 ' M' ' 35' ' ' VAL . 1.0 OUTLIER -52.83 -44.67 66.88 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.257 -0.429 . . . . 73.25 110.901 179.93 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -72.42 -28.41 62.95 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.189 -0.46 . . . . 63.530000000000001 111.104 179.937 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 9.0 ttm-85 -63.82 -16.79 62.14 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.176 -0.465 . . . . 75.420000000000002 110.873 -179.893 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -55.44 -20.8 13.56 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.204 -0.453 . . . . 73.409999999999997 110.881 179.936 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 3.8 ttt -54.18 -60.65 3.06 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.264 -0.426 . . . . 72.540000000000006 110.902 179.843 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 58.6 mttt -151.15 -171.93 4.07 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.255 -0.43 . . . . 71.430000000000007 110.951 179.945 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 63.5 57.54 1.46 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.234 -0.439 . . . . 73.140000000000001 110.857 179.873 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . 0.592 HG21 ' C ' ' M' ' 28' ' ' GLN . 2.9 m -161.29 128.53 4.09 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.157 -0.474 . . . . 71.420000000000002 111.124 -179.911 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -173.51 -38.47 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.21 -0.45 . . . . 62.200000000000003 110.878 179.932 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 20.1 m -58.44 -27.48 64.4 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.213 -0.449 . . . . 65.150000000000006 110.861 -179.768 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 15.4 mm-40 -98.81 -45.52 5.98 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.18 -0.464 . . . . 71.340000000000003 110.92 -179.969 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 -59.69 -38.17 80.83 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.128 -0.487 . . . . 71.150000000000006 110.884 -179.94 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 16.5 tp10 -60.48 -43.24 97.17 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.144 -0.48 . . . . 64.109999999999999 110.886 -179.906 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.817 HG21 HG22 ' A' ' 142' ' ' VAL . 32.4 mt -75.19 -51.01 22.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.13 -0.486 . . . . 62.130000000000003 111.108 179.976 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 2.3 tmt_? -56.26 -53.63 54.95 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.187 -0.461 . . . . 64.109999999999999 110.856 -179.987 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.729 ' O ' HG23 ' A' ' 91' ' ' VAL . 11.7 tm-20 -56.77 -56.08 26.06 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.173 -0.467 . . . . 72.420000000000002 110.885 -179.948 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -53.33 -50.93 63.97 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.204 -0.453 . . . . 43.130000000000003 111.113 179.921 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 5.1 t80 -61.03 -35.15 76.14 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.237 -0.438 . . . . 73.239999999999995 110.832 -179.888 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 14.8 ttt-85 -72.42 -27.48 62.36 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.136 -0.484 . . . . 64.209999999999994 110.911 -179.928 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . 0.729 HG23 ' O ' ' A' ' 87' ' ' GLU . 86.2 t -75.12 -28.02 20.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.176 -0.465 . . . . 75.120000000000005 111.14 179.98 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 8.7 m-85 -95.72 -30.34 13.79 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.152 -0.476 . . . . 74.299999999999997 110.872 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 43.7 t0 -76.68 89.41 3.36 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.168 -0.469 . . . . 72.319999999999993 110.883 179.995 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 34.0 mmtt -78.02 -48.77 15.41 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.185 -0.461 . . . . 64.109999999999999 110.929 179.982 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 9.5 p30 -72.58 -9.09 58.16 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.237 -0.438 . . . . 74.109999999999999 110.841 179.903 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 60.04 28.83 66.95 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.7 -0.762 . . . . 65.239999999999995 112.504 -179.933 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 43.8 p-10 -81.89 -16.1 51.77 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.89 0.376 . . . . 72.010000000000005 110.915 -179.885 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 82.36 18.72 65.93 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.746 -0.74 . . . . 43.119999999999997 112.5 179.966 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 19.0 m-85 -137.56 136.63 37.78 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.849 0.357 . . . . 54.030000000000001 110.917 -179.76 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 79.9 mt -106.05 124.94 61.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.141 -0.482 . . . . 72.129999999999995 111.112 179.939 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 40.2 p -116.45 176.22 5.21 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.175 -0.466 . . . . 72.310000000000002 110.883 -179.945 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -60.28 -38.88 84.95 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.12 -0.491 . . . . 65.549999999999997 111.13 179.881 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -62.42 -39.6 93.83 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.211 -0.449 . . . . 63.109999999999999 111.074 179.933 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . 0.725 ' O ' HG23 ' A' ' 108' ' ' VAL . 54.6 mt-10 -73.46 -51.56 16.76 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.207 -0.451 . . . . 73.439999999999998 110.874 -179.926 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.424 HD11 HD13 ' M' ' 19' ' ' ILE . 17.2 tp -56.2 -44.52 79.54 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.195 -0.457 . . . . 73.040000000000006 110.918 -179.955 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 27.5 ttt180 -52.59 -49.2 65.48 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.211 -0.45 . . . . 72.450000000000003 110.832 179.958 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 81.0 t60 -65.57 -34.81 79.11 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.18 -0.463 . . . . 74.319999999999993 110.86 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.725 HG23 ' O ' ' A' ' 104' ' ' GLU . 91.2 t -59.18 -52.28 62.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.229 -0.442 . . . . 55.420000000000002 111.145 179.974 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 2.2 tpt -56.16 -36.35 68.21 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.19 -0.459 . . . . 64.239999999999995 110.875 179.893 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -53.56 -35.26 60.58 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.261 -0.427 . . . . 71.040000000000006 111.129 -179.917 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 5.2 t30 -74.53 -26.57 60.06 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.197 -0.456 . . . . 74.209999999999994 110.897 -179.985 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 15.4 mt -77.73 -25.37 49.25 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.141 -0.481 . . . . 74.439999999999998 110.894 179.976 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 101.07 32.97 5.11 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.716 -0.754 . . . . 43.049999999999997 112.498 179.877 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 21.2 mm-40 -129.43 110.11 11.62 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.931 0.396 . . . . 72.340000000000003 110.85 -179.852 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . 0.426 ' O ' HD23 ' A' ' 116' ' ' LEU . 20.8 pttp -72.59 135.83 45.63 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.104 -0.498 . . . . 52.0 110.901 179.961 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.558 HD21 ' HD3' ' M' ' 15' ' ' LYS . 75.0 mt -138.23 157.57 46.02 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.259 -0.428 . . . . 62.530000000000001 110.894 179.914 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 69.6 p -107.74 163.26 13.25 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.184 -0.462 . . . . 72.540000000000006 111.146 179.959 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 14.2 m-20 -52.12 -40.87 61.96 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.219 -0.446 . . . . 53.409999999999997 110.844 179.913 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 59.7 tt0 -72.98 -33.52 65.88 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.185 -0.461 . . . . 71.430000000000007 110.898 -179.881 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . 0.497 ' HG2' HD22 ' A' ' 116' ' ' LEU . 6.1 tp10 -66.5 -44.33 82.85 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.109 -0.496 . . . . 72.040000000000006 110.904 -179.953 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 91.1 t -57.81 -31.07 39.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.152 -0.476 . . . . 63.539999999999999 111.08 -179.994 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 19.0 t0 -59.62 -45.39 92.08 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.235 -0.439 . . . . 74.140000000000001 110.859 179.928 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -55.81 -30.3 61.15 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.182 -0.463 . . . . 73.019999999999996 110.888 -179.909 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 4.3 mtt -76.01 -59.41 2.77 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.111 -0.495 . . . . 73.120000000000005 110.929 179.956 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 36.1 mm -53.99 -35.5 28.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.234 -0.439 . . . . 75.400000000000006 111.138 179.973 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 52.8 ttt85 -63.01 -31.79 73.01 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.178 -0.464 . . . . 75.25 110.875 179.944 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 31.7 tp10 -75.14 -52.44 10.99 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.164 -0.471 . . . . 72.319999999999993 110.895 -179.912 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.511 ' HB3' HG22 ' A' ' 136' ' ' VAL . . . -64.86 -34.47 78.46 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.149 -0.478 . . . . 65.420000000000002 111.119 179.889 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 48.7 t0 -68.46 86.93 0.3 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.219 -0.446 . . . . 73.420000000000002 110.861 -179.973 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . 0.764 HD12 ' HG2' ' A' ' 140' ' ' GLU . 7.8 mt -79.97 -46.88 22.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.184 -0.462 . . . . 75.450000000000003 111.108 -179.984 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 21.1 p30 -72.47 -8.84 57.18 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.199 -0.455 . . . . 74.510000000000005 110.908 179.836 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 63.15 44.47 97.12 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.767 -0.73 . . . . 72.25 112.476 -179.97 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 35.5 p-10 -90.67 -15.95 29.45 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.86 0.362 . . . . 60.329999999999998 110.883 -179.948 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 102.79 3.02 49.54 Favored Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 120.75 -0.738 . . . . 73.420000000000002 112.492 -179.96 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 5.3 tt0 -149.27 172.3 15.09 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.824 0.345 . . . . 75.120000000000005 110.932 -179.925 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 136' ' ' VAL . . . . . 0.511 HG22 ' HB3' ' A' ' 128' ' ' ALA . 60.0 t -112.03 109.1 27.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.236 -0.438 . . . . 54.329999999999998 111.133 179.991 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 17.2 p30 -90.52 173.04 8.29 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.205 -0.452 . . . . 74.109999999999999 110.916 179.985 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . 0.666 ' O ' HG23 ' A' ' 142' ' ' VAL . 55.4 t80 -58.75 -47.44 84.64 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.213 -0.449 . . . . 72.140000000000001 110.94 -179.926 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . 0.555 ' HB2' ' HB3' ' A' ' 46' ' ' ALA . 78.4 tt0 -51.89 -39.69 59.44 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.095 -0.502 . . . . 72.239999999999995 110.929 179.986 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . 0.764 ' HG2' HD12 ' A' ' 130' ' ' ILE . 89.6 mt-10 -78.09 -38.31 44.45 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.135 -0.484 . . . . 71.040000000000006 110.876 -179.938 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 51.7 t80 -63.19 -35.55 80.69 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.195 -0.457 . . . . 74.200000000000003 110.841 -179.93 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . 0.817 HG22 HG21 ' A' ' 85' ' ' ILE . 99.5 t -64.43 -44.43 97.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.149 -0.478 . . . . 75.150000000000006 111.138 -179.99 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 14.5 tt0 -74.03 -30.49 62.46 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.138 -0.483 . . . . 73.329999999999998 110.901 -179.993 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 6.9 tpt -73.1 -30.68 63.84 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.177 -0.465 . . . . 52.310000000000002 110.88 -179.999 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 145' ' ' MET . . . . . 0.518 ' HE1' HG22 ' M' ' 19' ' ' ILE . 0.0 OUTLIER -82.48 -26.22 32.8 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.241 -0.436 . . . . 73.340000000000003 110.865 179.954 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 87.3 m -85.3 -25.64 27.08 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.217 -0.447 . . . . 73.439999999999998 111.172 -179.927 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -60.42 115.73 3.78 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.23 -0.441 . . . . 71.109999999999999 111.072 179.863 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 52.6 tttm . . . . . 0 C--N 1.329 -0.297 0 CA-C-N 116.225 -0.443 . . . . 75.439999999999998 110.911 179.968 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' M' M ' 8' ' ' LEU . . . . . . . . . . . . . 18.9 mt . . . . . 0 C--O 1.23 0.076 0 CA-C-O 120.859 0.361 . . . . 74.329999999999998 110.896 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' M' M ' 9' ' ' SER . . . . . . . . . . . . . 5.2 p -123.48 178.78 5.02 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.176 -0.465 . . . . 60.210000000000001 110.891 -179.99 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' M' M ' 10' ' ' GLY . . . . . . . . . . . . . . . -165.34 -119.63 0.49 Allowed Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.739 -0.743 . . . . 74.409999999999997 112.48 -179.938 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' M' M ' 11' ' ' GLY . . . . . . . . . . . . . . . -80.16 -42.01 11.28 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.738 -0.744 . . . . 52.210000000000001 112.463 -179.898 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' M' M ' 12' ' ' GLU . . . . . . . . . . . . . 5.5 pt-20 -110.78 -174.68 2.53 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.865 0.364 . . . . 74.329999999999998 110.916 -179.919 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' M' M ' 13' ' ' LEU . . . . . 0.771 HD22 ' HG2' ' M' ' 15' ' ' LYS . 2.5 tt -88.52 129.22 35.51 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.151 -0.477 . . . . 60.350000000000001 110.912 -179.962 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' M' M ' 14' ' ' ASP . . . . . 0.602 ' N ' HD23 ' M' ' 13' ' ' LEU . 34.6 t0 -79.51 58.77 2.77 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.131 -0.486 . . . . 44.350000000000001 110.846 179.882 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' M' M ' 15' ' ' LYS . . . . . 0.771 ' HG2' HD22 ' M' ' 13' ' ' LEU . 12.8 mttm -67.48 -43.12 81.73 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.185 -0.461 . . . . 65.430000000000007 110.87 179.992 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' M' M ' 16' ' ' TRP . . . . . 0.713 ' CE3' HD12 ' M' ' 19' ' ' ILE . 7.8 m95 -51.79 -46.63 64.26 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.21 -0.45 . . . . 71.409999999999997 110.906 179.957 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' M' M ' 17' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -56.17 -28.44 58.1 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.262 -0.426 . . . . 71.319999999999993 110.882 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' M' M ' 18' ' ' LYS . . . . . . . . . . . . . 6.2 ttpm? -76.7 -26.01 54.24 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.15 -0.477 . . . . 62.020000000000003 110.883 179.98 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' M' M ' 19' ' ' ILE . . . . . 0.713 HD12 ' CE3' ' M' ' 16' ' ' TRP . 76.6 mt -79.35 -22.66 12.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.259 -0.428 . . . . 71.109999999999999 111.126 179.871 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' M' M ' 20' ' ' ARG . . . . . . . . . . . . . 47.7 ttp85 -68.79 -28.21 66.57 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.188 -0.46 . . . . 74.209999999999994 110.874 179.993 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' M' M ' 21' ' ' LEU . . . . . . . . . . . . . 6.8 mt 63.23 -169.94 0.18 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.178 -0.464 . . . . 75.120000000000005 110.898 -179.96 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' M' M ' 22' ' ' ARG . . . . . . . . . . . . . 7.2 mmt85 -106.95 158.8 32.01 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.65 0.738 . . . . 75.510000000000005 110.821 179.963 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' M' M ' 23' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.73 90.81 0.51 Allowed 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.716 2.277 . . . . 70.109999999999999 112.318 -179.987 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' M' M ' 24' ' ' GLY . . . . . . . . . . . . . . . 172.24 118.31 0.48 Allowed Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.786 -0.721 . . . . 62.229999999999997 112.534 179.991 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' M' M ' 25' ' ' GLY . . . . . . . . . . . . . . . 173.47 -151.9 14.45 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.778 -0.725 . . . . 62.149999999999999 112.518 -179.923 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' M' M ' 26' ' ' LYS . . . . . . . . . . . . . 11.3 mmtp -52.09 164.93 0.24 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.831 0.348 . . . . 65.239999999999995 110.917 179.972 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' M' M ' 27' ' ' LYS . . . . . . . . . . . . . 31.4 mtmm -148.42 103.04 3.39 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.26 -0.427 . . . . 71.319999999999993 110.894 179.849 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' M' M ' 28' ' ' GLN . . . . . 0.592 ' C ' HG21 ' A' ' 79' ' ' THR . 8.0 tt0 -177.0 141.46 0.34 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.204 -0.453 . . . . 74.150000000000006 110.912 179.964 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' M' M ' 29' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -51.99 149.43 5.06 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.207 -0.451 . . . . 75.549999999999997 110.918 -179.861 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' M' M ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.22 23.73 5.55 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.105 -0.498 . . . . 64.120000000000005 110.898 179.879 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' M' M ' 31' ' ' LEU . . . . . 0.543 HD13 ' CE ' ' A' ' 51' ' ' MET . 19.6 tp -130.08 -44.33 1.16 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.24 -0.437 . . . . 62.350000000000001 110.905 179.899 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' M' M ' 32' ' ' LYS . . . . . 0.404 ' O ' HG23 ' M' ' 35' ' ' VAL . 3.2 tttt -49.15 -43.71 42.02 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.201 -0.454 . . . . 73.040000000000006 110.925 179.849 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' M' M ' 33' ' ' HIS . . . . . . . . . . . . . 11.9 t60 -50.92 -39.01 53.63 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.227 -0.442 . . . . 72.129999999999995 110.841 179.853 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' M' M ' 34' ' ' ILE . . . . . . . . . . . . . 50.3 mm -51.26 -38.18 19.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.24 -0.436 . . . . 63.399999999999999 111.151 179.994 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' M' M ' 35' ' ' VAL . . . . . 0.45 HG21 ' HE2' ' A' ' 72' ' ' MET . 44.1 t -48.88 -38.84 10.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.2 -0.454 . . . . 71.530000000000001 111.18 179.819 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' M' M ' 36' ' ' TRP . . . . . . . . . . . . . 20.1 m0 -58.46 -40.31 82.32 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.154 -0.475 . . . . 65.420000000000002 110.871 179.975 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' M' M ' 37' ' ' ALA . . . . . 1.03 ' HB3' HD13 ' A' ' 39' ' ' LEU . . . -63.89 -18.85 64.6 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.283 -0.417 . . . . 72.109999999999999 111.089 179.891 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' M' M ' 38' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -81.39 -17.79 47.76 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.215 -0.448 . . . . 75.030000000000001 110.882 -179.763 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' M' M ' 39' ' ' ARG . . . . . . . . . . . . . 20.3 ttt-85 -54.99 -26.63 38.12 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.129 -0.487 . . . . 74.099999999999994 110.906 -179.975 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' M' M ' 40' ' ' GLU . . . . . . . . . . . . . 71.9 mt-10 -87.35 -45.69 10.34 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.166 -0.47 . . . . 74.120000000000005 110.892 -179.948 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' M' M ' 41' ' ' LEU . . . . . 0.673 HD21 ' OG ' ' A' ' 38' ' ' SER . 10.7 mt -52.77 110.28 0.5 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.153 -0.476 . . . . 70.230000000000004 110.92 179.994 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' M' M ' 42' ' ' GLU . . . . . . . . . . . . . 29.5 mt-10 52.27 79.66 0.11 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.163 -0.471 . . . . 72.319999999999993 110.898 179.951 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' M' M ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.328 0 CA-C-N 116.191 -0.459 . . . . 74.120000000000005 110.917 -179.952 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 241' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 262' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 301' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 322' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.101 0 CA-C-O 120.738 0.304 . . . . 54.399999999999999 111.135 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 59.24 83.9 0.12 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.227 -0.442 . . . . 72.439999999999998 110.88 179.98 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 12.8 mp0 -54.43 -71.51 0.08 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.17 -0.468 . . . . 62.109999999999999 110.896 -179.88 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.484 HD13 ' CG ' ' A' ' 8' ' ' GLN . 4.1 mm? -83.81 109.32 17.44 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.198 -0.455 . . . . 61.25 110.935 179.984 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 41.2 p -97.1 174.08 6.93 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.189 -0.46 . . . . 73.209999999999994 111.167 179.944 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 15.9 tm-20 -56.33 -37.83 70.49 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.254 -0.43 . . . . 63.030000000000001 110.879 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 47.1 tt0 -67.63 -33.72 75.55 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.172 -0.467 . . . . 71.25 110.851 -179.907 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . 0.484 ' CG ' HD13 ' A' ' 4' ' ' LEU . 9.1 tp-100 -78.03 -42.41 32.55 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.166 -0.47 . . . . 74.329999999999998 110.92 -179.905 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 59.5 mt -70.84 -45.48 73.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.161 -0.472 . . . . 72.030000000000001 111.125 179.969 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -54.73 -29.01 52.43 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.168 -0.469 . . . . 72.120000000000005 111.089 179.845 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 34.7 mm-40 -74.58 -52.23 12.37 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.212 -0.449 . . . . 71.340000000000003 110.915 -179.923 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 24.5 m-85 -63.05 -46.01 89.52 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.142 -0.481 . . . . 62.420000000000002 110.871 -179.924 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 2.5 tmtm? -54.69 -34.8 62.85 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.154 -0.475 . . . . 74.140000000000001 110.889 179.97 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 49.1 tt0 -64.91 -33.32 75.75 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.2 -0.455 . . . . 61.140000000000001 110.852 -179.994 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -66.8 -41.35 87.75 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.177 -0.465 . . . . 71.120000000000005 111.106 179.945 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 88.8 t80 -61.5 -54.28 45.29 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.194 -0.457 . . . . 72.230000000000004 110.877 -179.929 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 22.6 t -57.19 -26.45 60.66 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.15 -0.477 . . . . 51.219999999999999 110.858 -179.785 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.492 HD23 ' HB3' ' M' ' 38' ' ' SER . 15.3 tp -66.85 -44.32 81.35 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.136 -0.484 . . . . 75.319999999999993 110.921 -179.955 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.693 ' CD1' HG11 ' A' ' 35' ' ' VAL . 36.8 m-85 -74.61 -30.79 61.79 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.166 -0.47 . . . . 73.200000000000003 110.876 179.924 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 17.9 t0 -72.73 98.69 2.44 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.114 -0.494 . . . . 63.43 110.878 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 19.3 mtpp -68.97 -53.3 21.41 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.147 -0.479 . . . . 65.209999999999994 110.93 179.961 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 20.8 p-10 -74.18 -10.47 59.64 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.184 -0.462 . . . . 71.5 110.856 179.876 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 50.94 43.6 49.19 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.719 -0.753 . . . . 72.430000000000007 112.504 -179.918 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 35.7 p-10 -88.04 -15.61 35.88 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.824 0.345 . . . . 54.509999999999998 110.856 -179.966 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 105.38 -11.58 47.38 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.727 -0.749 . . . . 63.130000000000003 112.511 -179.922 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 9.9 p -132.99 130.7 39.84 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.764 0.316 . . . . 72.310000000000002 111.13 -179.891 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 22.2 mt -86.6 122.7 39.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.203 -0.453 . . . . 72.409999999999997 111.168 179.898 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 81.6 p -98.28 176.94 5.53 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.199 -0.455 . . . . 73.299999999999997 111.14 179.98 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.708 HG22 HD12 ' A' ' 52' ' ' ILE . 62.4 p -65.22 -45.05 86.27 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.222 -0.445 . . . . 71.120000000000005 111.147 -179.98 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 21.2 mtmm -64.22 -42.83 96.4 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.219 -0.446 . . . . 72.219999999999999 110.858 179.91 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -67.48 -32.7 73.72 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.248 -0.433 . . . . 72.519999999999996 110.844 -179.992 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.582 HD12 ' CD2' ' A' ' 48' ' ' LEU . 1.0 OUTLIER -68.35 -44.73 74.62 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.191 -0.459 . . . . 72.530000000000001 110.934 -179.95 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -71.76 -27.87 70.06 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.722 -0.752 . . . . 52.009999999999998 112.482 179.875 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 94.5 m -63.95 -54.22 37.96 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.808 0.337 . . . . 55.210000000000001 111.211 -179.889 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.693 HG11 ' CD1' ' A' ' 19' ' ' PHE . 47.2 t -58.18 -53.29 47.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.173 -0.467 . . . . 43.420000000000002 111.138 179.882 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 2.2 mtt -52.01 -36.61 50.52 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.181 -0.463 . . . . 75.420000000000002 110.856 179.938 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 34.5 ttt-85 -54.1 -46.7 72.15 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.204 -0.453 . . . . 74.409999999999997 110.859 -179.917 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . 0.632 ' OG ' HD21 ' M' ' 41' ' ' LEU . 3.1 t -68.81 -26.2 65.06 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.201 -0.454 . . . . 74.319999999999993 110.892 -179.805 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.986 HD13 ' HB3' ' M' ' 37' ' ' ALA . 39.0 mt -82.73 -18.16 41.77 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.114 -0.494 . . . . 73.010000000000005 110.918 179.974 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 101.55 28.61 6.62 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.76 -0.733 . . . . 61.130000000000003 112.496 179.924 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 8.1 mm100 -116.7 123.26 46.79 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.801 0.334 . . . . 71.120000000000005 110.923 -179.89 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 32.5 t-20 -109.91 76.76 1.0 Allowed Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 121.638 0.732 . . . . 63.200000000000003 110.876 -179.929 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.7 168.06 22.58 Favored 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.672 2.248 . . . . 65.299999999999997 112.314 179.939 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 19.5 p -112.77 154.09 26.76 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.177 -0.465 . . . . 71.120000000000005 111.118 -179.951 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 12.3 tp10 -51.96 -38.81 57.88 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.23 -0.441 . . . . 63.200000000000003 110.831 -179.991 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.34 -31.5 64.01 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.167 -0.47 . . . . 74.310000000000002 111.05 179.974 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 21.4 tt0 -72.94 -52.7 13.57 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.246 -0.434 . . . . 73.219999999999999 110.893 -179.924 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.582 ' CD2' HD12 ' A' ' 32' ' ' LEU . 34.6 mt -56.07 -49.14 74.61 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.145 -0.48 . . . . 74.439999999999998 110.893 -179.942 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 12.8 tp60 -56.86 -29.01 62.51 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.207 -0.451 . . . . 72.5 110.923 179.909 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -75.5 -49.66 18.08 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.168 -0.469 . . . . 75.230000000000004 110.891 179.966 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 32.6 mtp -60.61 -54.84 40.54 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.211 -0.45 . . . . 63.350000000000001 110.895 179.956 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.708 HD12 HG22 ' A' ' 29' ' ' THR . 65.9 mt -53.18 -42.83 47.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.264 -0.425 . . . . 65.109999999999999 111.123 179.934 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 76.0 m-20 -71.21 -27.09 63.24 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.204 -0.453 . . . . 61.329999999999998 110.865 179.974 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 10.8 tt0 -67.89 -28.95 67.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.195 -0.457 . . . . 73.319999999999993 110.893 179.994 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.499 HG13 ' CE2' ' M' ' 29' ' ' TYR . 3.4 m -112.03 16.92 7.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.155 -0.475 . . . . 62.219999999999999 111.133 179.951 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 28.8 t0 -88.89 99.55 12.49 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.198 -0.456 . . . . 73.439999999999998 110.854 179.908 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.3 -37.72 15.76 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.148 -0.478 . . . . 73.25 111.082 179.942 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -88.66 -0.32 57.17 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.222 -0.445 . . . . 62.399999999999999 110.866 179.981 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 51.37 57.89 10.93 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.746 -0.74 . . . . 43.32 112.466 -179.963 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 48.8 p-10 -114.56 -15.73 11.97 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.884 0.373 . . . . 73.150000000000006 110.894 -179.896 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 89.84 19.22 48.48 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.777 -0.725 . . . . 53.509999999999998 112.546 179.985 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 44.3 p -148.34 168.28 23.02 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.764 0.316 . . . . 73.200000000000003 111.144 -179.885 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.489 HD11 ' HA ' ' A' ' 52' ' ' ILE . 13.3 mm -100.93 109.48 25.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.214 -0.448 . . . . 74.140000000000001 111.15 179.894 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -76.2 -173.49 2.43 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.193 -0.458 . . . . 73.530000000000001 110.848 179.902 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.524 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 2.5 t80 -64.57 -58.51 13.27 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-O 121.651 0.738 . . . . 74.329999999999998 110.861 -179.895 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . 0.524 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 54.5 Cg_endo -69.69 -30.34 22.77 Favored 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 122.699 2.266 . . . . 51.539999999999999 112.38 179.981 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 18.1 mt-10 -57.17 -40.78 77.99 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.221 -0.445 . . . . 74.25 110.847 -179.957 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 12.5 t80 -74.11 -36.1 64.2 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.143 -0.48 . . . . 72.120000000000005 110.898 -179.918 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 29.0 tp -67.28 -53.74 27.14 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.137 -0.483 . . . . 75.120000000000005 110.935 -179.942 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 12.6 t -53.13 -27.56 21.43 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.173 -0.467 . . . . 73.310000000000002 111.101 179.941 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 56.1 ttp -67.51 -42.72 82.35 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.24 -0.436 . . . . 74.310000000000002 110.891 179.919 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 2.7 mtt -79.82 -31.71 40.62 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.214 -0.448 . . . . 71.030000000000001 110.863 179.998 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -66.52 -35.34 80.02 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.23 -0.441 . . . . 61.130000000000003 111.103 179.877 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 41.7 ttt180 -56.24 -25.26 47.04 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.236 -0.438 . . . . 62.420000000000002 110.866 -179.882 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -68.84 -35.31 76.8 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.195 -0.457 . . . . 51.350000000000001 110.908 179.928 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 4.5 tpt -56.08 -42.3 76.47 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.233 -0.44 . . . . 74.329999999999998 110.894 179.869 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 33.8 ttpt -68.58 113.2 5.88 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.205 -0.452 . . . . 65.219999999999999 110.913 179.948 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -152.71 166.73 31.26 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.242 -0.436 . . . . 74.099999999999994 110.828 179.897 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 3.5 m -103.94 -42.69 5.5 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.174 -0.466 . . . . 71.129999999999995 111.133 -179.889 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -55.03 -30.99 60.71 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.185 -0.462 . . . . 75.140000000000001 110.855 179.917 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 1.6 t -55.57 -37.42 68.02 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.172 -0.467 . . . . 75.219999999999999 110.874 -179.779 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.712 ' HA ' HD12 ' A' ' 85' ' ' ILE . 8.5 tt0 -52.92 -33.07 48.89 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.149 -0.478 . . . . 72.329999999999998 110.897 -179.979 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 4.2 tm-20 -67.65 -48.25 67.22 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.154 -0.475 . . . . 64.349999999999994 110.894 -179.898 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -59.3 -26.66 65.17 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.132 -0.486 . . . . 74.319999999999993 110.908 -179.989 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.743 HD13 HG13 ' A' ' 142' ' ' VAL . 58.2 mt -74.04 -51.13 25.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.165 -0.471 . . . . 73.230000000000004 111.135 179.959 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 13.5 ttt85 -61.7 -28.21 69.25 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.157 -0.474 . . . . 71.319999999999993 110.887 179.982 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.727 ' O ' HG23 ' A' ' 91' ' ' VAL . 17.5 tt0 -67.36 -58.01 5.58 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.199 -0.455 . . . . 75.030000000000001 110.886 -179.941 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . 0.449 ' HB1' ' CE2' ' A' ' 92' ' ' PHE . . . -59.52 -47.38 85.76 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.196 -0.457 . . . . 54.310000000000002 111.086 179.927 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -52.03 -43.89 63.95 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.181 -0.463 . . . . 74.530000000000001 110.866 -179.878 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 60.8 ttt180 -69.53 -32.19 70.87 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.135 -0.484 . . . . 73.239999999999995 110.899 -179.917 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . 0.727 HG23 ' O ' ' A' ' 87' ' ' GLU . 90.8 t -68.5 -27.76 37.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.172 -0.467 . . . . 64.310000000000002 111.13 179.957 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.449 ' CE2' ' HB1' ' A' ' 88' ' ' ALA . 9.1 m-85 -93.68 -33.33 13.69 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.198 -0.455 . . . . 74.519999999999996 110.904 179.994 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 25.8 t0 -64.25 96.75 0.16 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.159 -0.473 . . . . 75.209999999999994 110.874 179.965 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 7.4 tppt? -78.72 -53.21 7.38 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.16 -0.473 . . . . 73.409999999999997 110.914 -179.992 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 56.4 p-10 -72.85 -9.07 58.26 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.249 -0.432 . . . . 75.510000000000005 110.891 179.848 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 59.63 26.68 62.73 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.772 -0.727 . . . . 63.450000000000003 112.448 -179.981 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 39.3 p-10 -81.8 -16.14 51.91 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.869 0.366 . . . . 63.420000000000002 110.895 -179.864 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 88.48 18.72 54.53 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.727 -0.749 . . . . 74.299999999999997 112.441 179.946 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 19.0 m-85 -140.52 150.19 43.41 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.889 0.376 . . . . 74.310000000000002 110.944 -179.823 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 62.3 mt -120.98 133.48 67.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.111 -0.495 . . . . 53.420000000000002 111.157 179.907 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 97.8 p -114.44 177.74 4.53 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.174 -0.466 . . . . 72.540000000000006 110.897 -179.896 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . 0.679 ' O ' HG11 ' A' ' 121' ' ' VAL . . . -60.66 -34.54 74.45 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.201 -0.454 . . . . 72.099999999999994 111.081 179.927 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -71.9 -49.33 38.78 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.279 -0.419 . . . . 70.109999999999999 111.093 179.966 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 17.4 mt-10 -63.01 -46.52 87.27 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.202 -0.454 . . . . 51.409999999999997 110.893 -179.922 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 26.4 tp -52.98 -42.7 65.79 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.137 -0.483 . . . . 73.230000000000004 110.887 -179.977 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . 0.705 ' HB2' HG21 ' A' ' 121' ' ' VAL . 5.9 ttt-85 -62.13 -34.95 77.33 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.219 -0.446 . . . . 71.140000000000001 110.873 179.952 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 16.5 t60 -58.52 -34.9 71.48 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.175 -0.466 . . . . 74.439999999999998 110.871 179.998 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.591 ' O ' HD12 ' A' ' 112' ' ' LEU . 58.0 t -70.99 -39.17 74.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.242 -0.435 . . . . 64.219999999999999 111.084 -179.99 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . 0.619 ' CB ' HD12 ' A' ' 116' ' ' LEU . 5.1 mmt -76.43 -26.67 55.73 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.229 -0.441 . . . . 75.540000000000006 110.885 179.917 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 40.4 m -71.66 -56.04 6.57 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.221 -0.445 . . . . 74.239999999999995 111.164 -179.952 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -56.09 -31.16 62.99 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.219 -0.446 . . . . 72.120000000000005 110.921 179.956 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.591 HD12 ' O ' ' A' ' 108' ' ' VAL . 3.2 mt -71.46 -25.86 62.47 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.137 -0.483 . . . . 73.439999999999998 110.931 179.982 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 100.95 33.01 5.13 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.777 -0.725 . . . . 62.229999999999997 112.508 179.933 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 29.6 tp10 -110.08 110.18 20.98 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.932 0.396 . . . . 75.230000000000004 110.875 -179.896 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 30.9 mttm -60.79 102.68 0.2 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.124 -0.489 . . . . 73.200000000000003 110.894 179.984 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.619 HD12 ' CB ' ' A' ' 109' ' ' MET . 81.1 mt -138.95 146.76 41.39 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.222 -0.445 . . . . 52.25 110.937 179.893 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . 0.611 ' O ' HG23 ' A' ' 121' ' ' VAL . 41.8 p -112.62 175.12 5.57 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.185 -0.461 . . . . 71.409999999999997 111.131 179.934 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -57.1 -45.05 83.71 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.175 -0.466 . . . . 73.230000000000004 110.877 179.882 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 13.6 tp10 -62.55 -33.64 75.33 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.174 -0.466 . . . . 70.209999999999994 110.871 -179.898 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 18.5 tt0 -73.84 -31.4 63.18 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.184 -0.462 . . . . 75.209999999999994 110.91 -179.942 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.705 HG21 ' HB2' ' A' ' 106' ' ' ARG . 65.0 t -72.5 -30.72 35.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.135 -0.484 . . . . 61.409999999999997 111.083 -179.986 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -51.94 -47.24 64.8 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.193 -0.458 . . . . 74.430000000000007 110.86 179.928 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . 0.649 ' HG2' HD23 ' M' ' 13' ' ' LEU . 13.0 tp10 -56.79 -29.51 62.75 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.201 -0.454 . . . . 73.109999999999999 110.917 -179.917 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 17.2 mtp -73.96 -59.01 2.92 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.129 -0.487 . . . . 72.400000000000006 110.898 179.973 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 35.4 mm -53.93 -35.76 28.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.211 -0.45 . . . . 74.519999999999996 111.161 179.926 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 63.8 ttt180 -65.13 -31.83 73.22 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.15 -0.477 . . . . 71.219999999999999 110.888 179.944 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -72.46 -50.2 27.82 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.158 -0.474 . . . . 73.340000000000003 110.871 -179.931 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.614 ' HB3' HG22 ' A' ' 136' ' ' VAL . . . -69.36 -34.01 73.94 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.204 -0.453 . . . . 74.319999999999993 111.064 179.961 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 50.3 t0 -68.41 86.6 0.29 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.229 -0.442 . . . . 72.430000000000007 110.818 -179.984 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 60.0 mt -79.93 -45.56 22.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.221 -0.445 . . . . 73.200000000000003 111.091 179.969 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 22.6 p30 -72.73 -8.79 57.12 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.192 -0.458 . . . . 73.329999999999998 110.827 179.928 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 62.77 43.34 99.1 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.717 -0.754 . . . . 50.329999999999998 112.512 -179.932 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 32.5 p-10 -88.69 -16.02 33.38 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.902 0.382 . . . . 53.420000000000002 110.888 -179.944 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 103.37 2.94 47.67 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.691 -0.766 . . . . 34.030000000000001 112.482 -179.936 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 5.1 tt0 -149.25 172.26 15.15 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.799 0.333 . . . . 71.019999999999996 110.898 -179.861 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 136' ' ' VAL . . . . . 0.614 HG22 ' HB3' ' A' ' 128' ' ' ALA . 96.1 t -109.89 118.69 57.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.181 -0.463 . . . . 74.519999999999996 111.143 179.963 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 44.2 p-10 -102.16 166.85 10.37 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.204 -0.453 . . . . 65.340000000000003 110.928 179.989 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . 0.704 ' O ' HG23 ' A' ' 142' ' ' VAL . 48.0 t80 -51.9 -45.62 64.26 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.206 -0.452 . . . . 72.340000000000003 110.913 -179.893 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 6.1 tm-20 -53.4 -40.61 65.19 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.122 -0.49 . . . . 74.400000000000006 110.833 -179.941 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 17.5 mt-10 -78.43 -34.5 47.82 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.154 -0.476 . . . . 74.019999999999996 110.906 -179.91 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 41.1 t80 -67.15 -35.41 79.64 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.184 -0.462 . . . . 72.319999999999993 110.856 -179.925 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . 0.743 HG13 HD13 ' A' ' 85' ' ' ILE . 97.8 t -64.67 -44.04 96.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.179 -0.464 . . . . 54.409999999999997 111.105 -179.998 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . 0.56 ' HA ' HG22 ' A' ' 146' ' ' THR . 48.6 tt0 -74.23 -23.84 59.23 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.214 -0.448 . . . . 73.230000000000004 110.88 -179.954 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 8.7 tpt -74.99 -18.85 60.3 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.169 -0.469 . . . . 71.120000000000005 110.911 179.97 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 9.2 ttm -98.23 -30.75 12.44 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.22 -0.445 . . . . 72.420000000000002 110.884 179.971 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 146' ' ' THR . . . . . 0.56 HG22 ' HA ' ' A' ' 143' ' ' GLN . 4.7 t -76.76 -23.56 52.97 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.236 -0.438 . . . . 75.430000000000007 111.174 -179.993 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -87.89 -75.51 0.41 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.194 -0.457 . . . . 73.109999999999999 111.081 179.846 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 17.0 mttm . . . . . 0 C--N 1.328 -0.336 0 CA-C-N 116.215 -0.448 . . . . 51.549999999999997 110.895 179.984 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' M' M ' 8' ' ' LEU . . . . . . . . . . . . . 4.2 pp . . . . . 0 C--O 1.231 0.11 0 CA-C-O 120.815 0.341 . . . . 53.43 110.961 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' M' M ' 9' ' ' SER . . . . . . . . . . . . . 55.2 m -148.13 179.12 7.98 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.203 -0.453 . . . . 71.519999999999996 110.867 -179.914 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' M' M ' 10' ' ' GLY . . . . . . . . . . . . . . . -142.24 -177.63 17.5 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.775 -0.726 . . . . 74.409999999999997 112.493 -179.972 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' M' M ' 11' ' ' GLY . . . . . . . . . . . . . . . 57.23 24.73 52.49 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.792 -0.718 . . . . 62.409999999999997 112.461 -179.937 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' M' M ' 12' ' ' GLU . . . . . . . . . . . . . 1.7 pt-20 -130.48 95.9 4.0 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.874 0.369 . . . . 74.409999999999997 110.887 -179.888 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' M' M ' 13' ' ' LEU . . . . . 0.649 HD23 ' HG2' ' A' ' 123' ' ' GLU . 0.9 OUTLIER -87.7 76.08 8.89 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.142 -0.481 . . . . 74.319999999999993 110.972 179.98 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' M' M ' 14' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -102.02 23.61 11.27 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.209 -0.45 . . . . 71.030000000000001 110.889 179.862 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' M' M ' 15' ' ' LYS . . . . . . . . . . . . . 40.5 mttp -79.09 -45.18 20.58 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.159 -0.473 . . . . 62.200000000000003 110.875 179.987 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' M' M ' 16' ' ' TRP . . . . . 0.514 ' CE3' HD12 ' M' ' 19' ' ' ILE . 24.2 m95 -53.77 -34.5 59.21 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.278 -0.419 . . . . 73.140000000000001 110.926 179.964 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' M' M ' 17' ' ' GLU . . . . . . . . . . . . . 5.3 tm-20 -58.67 -25.91 63.27 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.229 -0.441 . . . . 73.010000000000005 110.884 179.997 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' M' M ' 18' ' ' LYS . . . . . 0.568 ' NZ ' HD13 ' A' ' 112' ' ' LEU . 16.0 ttpp -67.66 -26.85 66.41 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.185 -0.461 . . . . 71.519999999999996 110.91 179.951 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' M' M ' 19' ' ' ILE . . . . . 0.514 HD12 ' CE3' ' M' ' 16' ' ' TRP . 28.2 mt -92.61 -22.81 5.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.215 -0.448 . . . . 51.140000000000001 111.13 179.879 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' M' M ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.63 -45.55 61.7 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.165 -0.471 . . . . 73.129999999999995 110.856 179.983 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' M' M ' 21' ' ' LEU . . . . . . . . . . . . . 8.1 mt 63.08 -174.81 0.15 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.192 -0.458 . . . . 74.409999999999997 110.923 -179.978 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' M' M ' 22' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -121.86 144.88 42.02 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.622 0.725 . . . . 73.329999999999998 110.848 179.938 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' M' M ' 23' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.75 -47.74 0.87 Allowed 'Trans proline' 0 C--N 1.341 0.163 0 C-N-CA 122.676 2.251 . . . . 72.25 112.346 179.988 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' M' M ' 24' ' ' GLY . . . . . . . . . . . . . . . 109.35 120.45 4.31 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.747 -0.74 . . . . 60.210000000000001 112.461 179.964 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' M' M ' 25' ' ' GLY . . . . . . . . . . . . . . . 69.4 117.75 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.697 -0.763 . . . . 51.420000000000002 112.527 -179.906 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' M' M ' 26' ' ' LYS . . . . . . . . . . . . . 29.9 mmtp -111.09 113.39 25.89 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.789 0.328 . . . . 63.43 110.908 -179.963 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' M' M ' 27' ' ' LYS . . . . . . . . . . . . . 21.7 tptp -164.09 128.98 2.8 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.249 -0.432 . . . . 63.439999999999998 110.894 179.832 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' M' M ' 28' ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 -138.1 -74.51 0.4 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.242 -0.435 . . . . 74.329999999999998 110.902 179.965 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' M' M ' 29' ' ' TYR . . . . . 0.499 ' CE2' HG13 ' A' ' 55' ' ' VAL . 2.2 m-85 -65.22 -79.73 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.234 -0.439 . . . . 72.120000000000005 110.955 -179.886 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' M' M ' 30' ' ' LYS . . . . . . . . . . . . . 2.1 mtpp 176.17 -42.99 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.121 -0.491 . . . . 71.030000000000001 110.887 179.9 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' M' M ' 31' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -82.89 -21.16 34.34 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.209 -0.45 . . . . 71.239999999999995 110.902 179.93 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' M' M ' 32' ' ' LYS . . . . . 0.408 ' O ' HG23 ' M' ' 35' ' ' VAL . 25.1 ttpp -48.04 -48.61 32.99 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.198 -0.455 . . . . 73.209999999999994 110.93 179.813 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' M' M ' 33' ' ' HIS . . . . . . . . . . . . . 11.1 t-80 -52.01 -37.5 53.5 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.233 -0.439 . . . . 75.510000000000005 110.846 179.87 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' M' M ' 34' ' ' ILE . . . . . 0.413 ' CG2' HD12 ' A' ' 39' ' ' LEU . 36.3 mm -51.66 -37.19 19.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.184 -0.462 . . . . 73.150000000000006 111.108 -179.991 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' M' M ' 35' ' ' VAL . . . . . 0.408 HG23 ' O ' ' M' ' 32' ' ' LYS . 46.3 t -49.48 -38.45 12.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.207 -0.451 . . . . 73.129999999999995 111.126 179.862 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' M' M ' 36' ' ' TRP . . . . . . . . . . . . . 16.9 m0 -58.6 -39.52 80.63 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.19 -0.459 . . . . 74.099999999999994 110.919 179.999 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' M' M ' 37' ' ' ALA . . . . . 0.986 ' HB3' HD13 ' A' ' 39' ' ' LEU . . . -63.44 -18.7 64.02 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.193 -0.458 . . . . 34.219999999999999 111.096 179.905 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' M' M ' 38' ' ' SER . . . . . 0.492 ' HB3' HD23 ' A' ' 18' ' ' LEU . 1.1 m -70.62 -18.03 62.87 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.18 -0.464 . . . . 72.219999999999999 110.908 -179.798 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' M' M ' 39' ' ' ARG . . . . . . . . . . . . . 8.7 mmm180 -61.48 -25.14 67.05 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.118 -0.492 . . . . 75.040000000000006 110.92 -179.963 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' M' M ' 40' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -85.51 -47.97 9.4 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.143 -0.48 . . . . 74.230000000000004 110.851 -179.904 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' M' M ' 41' ' ' LEU . . . . . 0.632 HD21 ' OG ' ' A' ' 38' ' ' SER . 12.0 mt -60.77 157.31 15.15 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.191 -0.458 . . . . 74.030000000000001 110.882 -179.933 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' M' M ' 42' ' ' GLU . . . . . . . . . . . . . 17.5 mt-10 -141.09 26.83 2.0 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.169 -0.469 . . . . 75.230000000000004 110.865 179.945 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' M' M ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.326 0 CA-C-N 116.17 -0.468 . . . . 74.430000000000007 110.854 -179.903 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 241' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 262' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 301' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 322' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_